(2-methylphenyl)methyl 1-(2-nitrophenyl)piperidine-4-carboxylate

Systemtic Name: (2-methylphenyl)methyl 1-(2-nitrophenyl)piperidine-4-carboxylate Openeye Name: o-tolylmethyl 1-(2-nitrophenyl)piperidine-4-carboxylate CAS Name: 1-(2-nitrophenyl)-4-piperidinecarboxylic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl 1-(2-nitrophenyl)piperidine-4-carboxylate Traditional Name: 1-(2-nitrophenyl)isonipecotic acid (2-methylbenzyl) ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1COC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O4/c1-15-6-2-3-7-17(15)14-26-20(23)16-10-12-21(13-11-16)18-8-4-5-9-19(18)22(24)25/h2-9,16H,10-14H2,1H3