4-(3-chlorophenyl)-2,6-dimethyl-5-[(4-phenylpiperazin-1-yl)carbamoyl]-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-[(4-phenylpiperazin-1-yl)carbamoyl]-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-[(4-phenylpiperazin-1-yl)carbamoyl]-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-[oxo-[(4-phenyl-1-piperazinyl)amino]methyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-[(4-phenylpiperazin-1-yl)carbamoyl]-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-[(4-phenylpiperazino)carbamoyl]-1,4-dihydropyridine-3-carboxylic acid Formula: C25H27ClN4O3 MolecularWeight: 466.95988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC(=CC=C2)Cl)C(=O)NN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC(=CC=C2)Cl)C(=O)NN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H27ClN4O3/c1-16-21(23(18-7-6-8-19(26)15-18)22(25(32)33)17(2)27-16)24(31)28-30-13-11-29(12-14-30)20-9-4-3-5-10-20/h3-10,15,23,27H,11-14H2,1-2H3,(H,28,31)(H,32,33)