(2,5-dimethylphenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: (2,5-dimethylphenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: (2,5-dimethylphenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid (2,5-dimethylbenzyl) ester Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC(=O)C2CCN(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC(=O)C2CCN(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O3/c1-16-8-9-17(2)19(14-16)15-27-21(25)18-10-12-24(13-11-18)22(26)23-20-6-4-3-5-7-20/h3-9,14,18H,10-13,15H2,1-2H3,(H,23,26)