(2-methylphenyl)methyl 1-(4-chlorophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: (2-methylphenyl)methyl 1-(4-chlorophenyl)carbonylpiperidine-4-carboxylate Openeye Name: o-tolylmethyl 1-(4-chlorobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-4-piperidinecarboxylic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl 1-(4-chlorobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-chlorobenzoyl)isonipecotic acid (2-methylbenzyl) ester Formula: C21H22ClNO3 MolecularWeight: 371.85728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1COC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClNO3/c1-15-4-2-3-5-18(15)14-26-21(25)17-10-12-23(13-11-17)20(24)16-6-8-19(22)9-7-16/h2-9,17H,10-14H2,1H3