4-(3-chlorophenyl)-6-cyano-2-methyl-5-[(E)-3-phenylprop-2-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)-6-cyano-2-methyl-5-[(E)-3-phenylprop-2-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-5-[(E)-cinnamyl]oxycarbonyl-6-cyano-2-methyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(3-chlorophenyl)-6-cyano-2-methyl-5-[oxo-[(E)-3-phenylprop-2-enoxy]methyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(3-chlorophenyl)-6-cyano-2-methyl-5-[(E)-3-phenylprop-2-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-5-[(E)-cinnamyl]oxycarbonyl-6-cyano-2-methyl-1,4-dihydropyridine-3-carboxylic acid Formula: C24H19ClN2O4 MolecularWeight: 434.87166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C#N)C(=O)OCC=CC2=CC=CC=C2)C3=CC(=CC=C3)Cl)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C#N)C(=O)OC/C=C/C2=CC=CC=C2)C3=CC(=CC=C3)Cl)C(=O)O

InChI

InChI=1S/C24H19ClN2O4/c1-15-20(23(28)29)21(17-10-5-11-18(25)13-17)22(19(14-26)27-15)24(30)31-12-6-9-16-7-3-2-4-8-16/h2-11,13,21,27H,12H2,1H3,(H,28,29)/b9-6+