methyl 5-cyano-4-(3,4-dimethoxyphenyl)-2,6-dimethyl-1-(3-phenylpropyl)-4H-pyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-4-(3,4-dimethoxyphenyl)-2,6-dimethyl-1-(3-phenylpropyl)-4H-pyridine-3-carboxylate Openeye Name: methyl 5-cyano-4-(3,4-dimethoxyphenyl)-2,6-dimethyl-1-(3-phenylpropyl)-4H-pyridine-3-carboxylate CAS Name: 5-cyano-4-(3,4-dimethoxyphenyl)-2,6-dimethyl-1-(3-phenylpropyl)-4H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-4-(3,4-dimethoxyphenyl)-2,6-dimethyl-1-(3-phenylpropyl)-4H-pyridine-3-carboxylate Traditional Name: 5-cyano-4-(3,4-dimethoxyphenyl)-2,6-dimethyl-1-(3-phenylpropyl)-4H-pyridine-3-carboxylic acid methyl ester Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1CCCC2=CC=CC=C2)C)C(=O)OC)C3=CC(=C(C=C3)OC)OC)C#N

Isomeric SMILES

CC1=C(C(C(=C(N1CCCC2=CC=CC=C2)C)C(=O)OC)C3=CC(=C(C=C3)OC)OC)C#N

InChI

InChI=1S/C27H30N2O4/c1-18-22(17-28)26(21-13-14-23(31-3)24(16-21)32-4)25(27(30)33-5)19(2)29(18)15-9-12-20-10-7-6-8-11-20/h6-8,10-11,13-14,16,26H,9,12,15H2,1-5H3