5-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-3,3-dimethyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-3,3-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-3,3-dimethyl-5-oxo-pentanoic acid CAS Name: 5-[4-[(4-chlorophenyl)-phenylmethyl]-1-piperazinyl]-3,3-dimethyl-5-oxopentanoic acid IUPAC Name: 5-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]-3,3-dimethyl-5-oxopentanoic acid Traditional Name: 5-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino]-5-keto-3,3-dimethyl-valeric acid Formula: C24H29ClN2O3 MolecularWeight: 428.95166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)CC(=O)O

Isomeric SMILES

CC(C)(CC(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)CC(=O)O

InChI

InChI=1S/C24H29ClN2O3/c1-24(2,17-22(29)30)16-21(28)26-12-14-27(15-13-26)23(18-6-4-3-5-7-18)19-8-10-20(25)11-9-19/h3-11,23H,12-17H2,1-2H3,(H,29,30)