methyl 4-[3-oxidanylidene-2-(phenylmethyl)piperazin-1-yl]carbonylbenzoate

Systemtic Name: methyl 4-[3-oxidanylidene-2-(phenylmethyl)piperazin-1-yl]carbonylbenzoate Openeye Name: methyl 4-(2-benzyl-3-oxo-piperazine-1-carbonyl)benzoate CAS Name: 4-[oxo-[3-oxo-2-(phenylmethyl)-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-(2-benzyl-3-oxopiperazine-1-carbonyl)benzoate Traditional Name: 4-(2-benzyl-3-keto-piperazine-1-carbonyl)benzoic acid methyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)N2CCNC(=O)C2CC3=CC=CC=C3

InChI

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