ethyl 3-[(2-methylphenyl)methyl]-1-pyridin-3-ylcarbonyl-piperidine-3-carboxylate

Systemtic Name: ethyl 3-[(2-methylphenyl)methyl]-1-pyridin-3-ylcarbonyl-piperidine-3-carboxylate Openeye Name: ethyl 3-(o-tolylmethyl)-1-(pyridine-3-carbonyl)piperidine-3-carboxylate CAS Name: 3-[(2-methylphenyl)methyl]-1-[oxo(3-pyridinyl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-methylphenyl)methyl]-1-(pyridine-3-carbonyl)piperidine-3-carboxylate Traditional Name: 3-(2-methylbenzyl)-1-nicotinoyl-nipecotic acid ethyl ester Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=CN=CC=C2)CC3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)C2=CN=CC=C2)CC3=CC=CC=C3C

InChI

InChI=1S/C22H26N2O3/c1-3-27-21(26)22(14-18-9-5-4-8-17(18)2)11-7-13-24(16-22)20(25)19-10-6-12-23-15-19/h4-6,8-10,12,15H,3,7,11,13-14,16H2,1-2H3