methyl 3-[(4-cyano-4-phenyl-piperidin-1-yl)carbonylamino]benzoate

Systemtic Name: methyl 3-[(4-cyano-4-phenyl-piperidin-1-yl)carbonylamino]benzoate Openeye Name: methyl 3-[(4-cyano-4-phenyl-piperidine-1-carbonyl)amino]benzoate CAS Name: 3-[[(4-cyano-4-phenyl-1-piperidinyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-cyano-4-phenylpiperidine-1-carbonyl)amino]benzoate Traditional Name: 3-[(4-cyano-4-phenyl-piperidine-1-carbonyl)amino]benzoic acid methyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)N2CCC(CC2)(C#N)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)N2CCC(CC2)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3/c1-27-19(25)16-6-5-9-18(14-16)23-20(26)24-12-10-21(15-22,11-13-24)17-7-3-2-4-8-17/h2-9,14H,10-13H2,1H3,(H,23,26)