2-[2-(4-methylphenyl)-6-oxidanylidene-4-(phenylcarbonyl)piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[2-(4-methylphenyl)-6-oxidanylidene-4-(phenylcarbonyl)piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-benzoyl-2-oxo-6-(p-tolyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-benzoyl-2-(4-methylphenyl)-6-oxo-1-piperazinyl]acetic acid IUPAC Name: 2-[4-benzoyl-2-(4-methylphenyl)-6-oxopiperazin-1-yl]acetic acid Traditional Name: 2-[4-benzoyl-2-keto-6-(p-tolyl)piperazino]acetic acid Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CN(CC(=O)N2CC(=O)O)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2CN(CC(=O)N2CC(=O)O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O4/c1-14-7-9-15(10-8-14)17-11-21(12-18(23)22(17)13-19(24)25)20(26)16-5-3-2-4-6-16/h2-10,17H,11-13H2,1H3,(H,24,25)