4-(3-chlorophenyl)-5-(3,3-diphenylprop-2-enoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)-5-(3,3-diphenylprop-2-enoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-5-(3,3-diphenylallyloxycarbonyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(3-chlorophenyl)-5-[3,3-diphenylprop-2-enoxy(oxo)methyl]-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(3-chlorophenyl)-5-(3,3-diphenylprop-2-enoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-5-(3,3-diphenylallyloxycarbonyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Formula: C30H26ClNO4 MolecularWeight: 499.98474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCC=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC(=CC=C4)Cl)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCC=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC(=CC=C4)Cl)C(=O)O

InChI

InChI=1S/C30H26ClNO4/c1-19-26(29(33)34)28(23-14-9-15-24(31)18-23)27(20(2)32-19)30(35)36-17-16-25(21-10-5-3-6-11-21)22-12-7-4-8-13-22/h3-16,18,28,32H,17H2,1-2H3,(H,33,34)