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

Systemtic Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-(4-phenylbutoxycarbonyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-(4-phenylbutoxycarbonyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-[oxo(4-phenylbutoxy)methyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-(4-phenylbutoxycarbonyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-(4-phenylbutoxycarbonyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C25H26ClNO4 MolecularWeight: 439.93124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCCCCC2=CC=CC=C2)C3=CC(=CC=C3)Cl)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCCCCC2=CC=CC=C2)C3=CC(=CC=C3)Cl)C(=O)O

InChI

InChI=1S/C25H26ClNO4/c1-16-21(24(28)29)23(19-12-8-13-20(26)15-19)22(17(2)27-16)25(30)31-14-7-6-11-18-9-4-3-5-10-18/h3-5,8-10,12-13,15,23,27H,6-7,11,14H2,1-2H3,(H,28,29)