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

Systemtic Name: (4-aminocarbonylphenyl)methyl 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate Openeye Name: (4-carbamoylphenyl)methyl 1-(2-methylbenzoyl)piperidine-4-carboxylate CAS Name: 1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxylic acid (4-carbamoylphenyl)methyl ester IUPAC Name: (4-carbamoylphenyl)methyl 1-(2-methylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-o-toluoylisonipecotic acid (4-carbamoylbenzyl) ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O4/c1-15-4-2-3-5-19(15)21(26)24-12-10-18(11-13-24)22(27)28-14-16-6-8-17(9-7-16)20(23)25/h2-9,18H,10-14H2,1H3,(H2,23,25)