methyl 4-[[1-(4-chlorophenyl)carbonylpiperidin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1-(4-chlorophenyl)carbonylpiperidin-3-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[1-(4-chlorobenzoyl)piperidine-3-carbonyl]amino]benzoate CAS Name: 4-[[[1-[(4-chlorophenyl)-oxomethyl]-3-piperidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(4-chlorobenzoyl)piperidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[1-(4-chlorobenzoyl)nipecotoyl]amino]benzoic acid methyl ester Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H21ClN2O4/c1-28-21(27)15-6-10-18(11-7-15)23-19(25)16-3-2-12-24(13-16)20(26)14-4-8-17(22)9-5-14/h4-11,16H,2-3,12-13H2,1H3,(H,23,25)