(2,4-dichlorophenyl)methyl 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: (2,4-dichlorophenyl)methyl 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate Openeye Name: (2,4-dichlorophenyl)methyl 1-(2-methylbenzoyl)piperidine-4-carboxylate CAS Name: 1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxylic acid (2,4-dichlorophenyl)methyl ester IUPAC Name: (2,4-dichlorophenyl)methyl 1-(2-methylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-o-toluoylisonipecotic acid (2,4-dichlorobenzyl) ester Formula: C21H21Cl2NO3 MolecularWeight: 406.30234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21Cl2NO3/c1-14-4-2-3-5-18(14)20(25)24-10-8-15(9-11-24)21(26)27-13-16-6-7-17(22)12-19(16)23/h2-7,12,15H,8-11,13H2,1H3