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

View entire compound with spectra: 2 NMR

6-Amino-4-[4-(diethylamino)phenyl]-3-(4-ethoxy-3-methoxyphenyl)-1,4-dihydropyrano[2,3-C]pyrazole-5-carbonitrile
SpectraBase Compound ID B0YA584OTmU
InChI InChI=1S/C26H29N5O3/c1-5-31(6-2)18-11-8-16(9-12-18)22-19(15-27)25(28)34-26-23(22)24(29-30-26)17-10-13-20(33-7-3)21(14-17)32-4/h8-14,22H,5-7,28H2,1-4H3,(H,29,30)
InChIKey HLFIMIFVTKEBJK-UHFFFAOYSA-N
Mol Weight 459.55 g/mol
Molecular Formula C26H29N5O3
Exact Mass 459.22704 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2r4ZivjNen4
Name 6-Amino-4-[4-(diethylamino)phenyl]-3-(4-ethoxy-3-methoxyphenyl)-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 459.227039811 u
Formula C26H29N5O3
InChI InChI=1S/C26H29N5O3/c1-5-31(6-2)18-11-8-16(9-12-18)22-19(15-27)25(28)34-26-23(22)24(29-30-26)17-10-13-20(33-7-3)21(14-17)32-4/h8-14,22H,5-7,28H2,1-4H3,(H,29,30)
InChIKey HLFIMIFVTKEBJK-UHFFFAOYSA-N
Molecular Weight 459.550 g/mol
SMILES NC1=C(C(C2=C(O1)NN=C2C=1C=C(OC)C(=CC1)OCC)C1=CC=C(C=C1)N(CC)CC)C#N