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4-[3-[6-[1-[[3-[6-[1-(4-carbethoxyphenyl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridyl]-4,5,6,7-tetrahydroindazol-1-yl]methyl]-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridyl]-4,5,6,7-tetrahydroindazol-1-yl]benzoic acid ethyl ester

View entire compound with spectra: 1 MS (GC)

4-[3-[6-[1-[[3-[6-[1-(4-carbethoxyphenyl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridyl]-4,5,6,7-tetrahydroindazol-1-yl]methyl]-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridyl]-4,5,6,7-tetrahydroindazol-1-yl]benzoic acid ethyl ester
SpectraBase Compound ID 8QtAZPIRtyN
InChI InChI=1S/C57H58N10O4/c1-3-70-56(68)36-27-31-38(32-28-36)66-50-25-11-7-17-42(50)54(62-66)46-21-13-19-44(58-46)52-40-15-5-9-23-48(40)64(60-52)35-65-49-24-10-6-16-41(49)53(61-65)45-20-14-22-47(59-45)55-43-18-8-12-26-51(43)67(63-55)39-33-29-37(30-34-39)57(69)71-4-2/h13-14,19-22,27-34H,3-12,15-18,23-26,35H2,1-2H3
InChIKey ZFRXLZDWKFQQNO-UHFFFAOYSA-N
Mol Weight 947.2 g/mol
Molecular Formula C57H58N10O4
Exact Mass 946.46425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I71godEUOB6
Name 4-[3-[6-[1-[[3-[6-[1-(4-carbethoxyphenyl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridyl]-4,5,6,7-tetrahydroindazol-1-yl]methyl]-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridyl]-4,5,6,7-tetrahydroindazol-1-yl]benzoic acid ethyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C57H58N10O4
InChI InChI=1S/C57H58N10O4/c1-3-70-56(68)36-27-31-38(32-28-36)66-50-25-11-7-17-42(50)54(62-66)46-21-13-19-44(58-46)52-40-15-5-9-23-48(40)64(60-52)35-65-49-24-10-6-16-41(49)53(61-65)45-20-14-22-47(59-45)55-43-18-8-12-26-51(43)67(63-55)39-33-29-37(30-34-39)57(69)71-4-2/h13-14,19-22,27-34H,3-12,15-18,23-26,35H2,1-2H3
InChIKey ZFRXLZDWKFQQNO-UHFFFAOYSA-N
Molecular Weight 947.157 g/mol
SMILES c1(n[n](c2c1CCCC2)C[n]1nc(-c2nc(-c3n[n](-c4ccc(C(=O)OCC)cc4)c4c3CCCC4)ccc2)c2c1CCCC2)-c1nc(-c2n[n](-c3ccc(C(=O)OCC)cc3)c3c2CCCC3)ccc1
SPLASH splash10-0006-9400000000-1551b03ecd86c0f9daf5
Source of Spectrum J-63-240-5
Synonyms 4-[3-[6-[1-[[3-[6-[1-(4-ethoxycarbonylphenyl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]-4,5,6,7-tetrahydroindazol-1-yl]methyl]-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridinyl]-4,5,6,7-tetrahydroindazol-1-yl]benzoic acid ethyl ester Ethyl 4-[3-[6-[1-[[3-[6-[1-(4-ethoxycarbonylphenyl)-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridyl]-4,5,6,7-tetrahydroindazol-1-yl]methyl]-4,5,6,7-tetrahydroindazol-3-yl]-2-pyridyl]-4,5,6,7-tetrahydroindazol-1-yl]benzoate Ethyl 4-[3-[6-[1-[[3-[6-[1-(4-ethoxycarbonylphenyl)-4,5,6,7-tetrahydroindazol-3-yl]pyridin-2-yl]-4,5,6,7-tetrahydroindazol-1-yl]methyl]-4,5,6,7-tetrahydroindazol-3-yl]pyridin-2-yl]-4,5,6,7-tetrahydroindazol-1-yl]benzoate
Wiley ID 1418227