(3-cyanophenyl)methyl 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: (3-cyanophenyl)methyl 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate Openeye Name: (3-cyanophenyl)methyl 1-(2-methylbenzoyl)piperidine-4-carboxylate CAS Name: 1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxylic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 1-(2-methylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-o-toluoylisonipecotic acid (3-cyanobenzyl) ester Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)OCC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)OCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C22H22N2O3/c1-16-5-2-3-8-20(16)21(25)24-11-9-19(10-12-24)22(26)27-15-18-7-4-6-17(13-18)14-23/h2-8,13,19H,9-12,15H2,1H3