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6-Amino-4-(4-methoxyphenyl)-3-(4-propoxyphenyl)-1,4-dihydropyrano[2,3-C]pyrazole-5-carbonitrile

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6-Amino-4-(4-methoxyphenyl)-3-(4-propoxyphenyl)-1,4-dihydropyrano[2,3-C]pyrazole-5-carbonitrile
SpectraBase Compound ID 4GmSo5Hzcr3
InChI InChI=1S/C23H22N4O3/c1-3-12-29-17-10-6-15(7-11-17)21-20-19(14-4-8-16(28-2)9-5-14)18(13-24)22(25)30-23(20)27-26-21/h4-11,19H,3,12,25H2,1-2H3,(H,26,27)
InChIKey WYOYJXFNELPZSA-UHFFFAOYSA-N
Mol Weight 402.45 g/mol
Molecular Formula C23H22N4O3
Exact Mass 402.169191 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I0z76SmL0x9
Name 6-Amino-4-(4-methoxyphenyl)-3-(4-propoxyphenyl)-1,4-dihydropyrano[2,3-C]pyrazole-5-carbonitrile
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 402.169190581 u
Formula C23H22N4O3
InChI InChI=1S/C23H22N4O3/c1-3-12-29-17-10-6-15(7-11-17)21-20-19(14-4-8-16(28-2)9-5-14)18(13-24)22(25)30-23(20)27-26-21/h4-11,19H,3,12,25H2,1-2H3,(H,26,27)
InChIKey WYOYJXFNELPZSA-UHFFFAOYSA-N
Molecular Weight 402.454 g/mol
SMILES NC1=C(C(C2=C(O1)NN=C2C=1C=CC(=CC1)OCCC)C=1C=CC(=CC1)OC)C#N