[2-oxidanylidene-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl] 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl] 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate Openeye Name: (2-oxo-2-tetralin-6-yl-ethyl) 1-(2-methylbenzoyl)piperidine-4-carboxylate CAS Name: 1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxylic acid [2-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl] 1-(2-methylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-o-toluoylisonipecotic acid (2-keto-2-tetralin-6-yl-ethyl) ester Formula: C26H29NO4 MolecularWeight: 419.51276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)OCC(=O)C3=CC4=C(CCCC4)C=C3

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)OCC(=O)C3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C26H29NO4/c1-18-6-2-5-9-23(18)25(29)27-14-12-20(13-15-27)26(30)31-17-24(28)22-11-10-19-7-3-4-8-21(19)16-22/h2,5-6,9-11,16,20H,3-4,7-8,12-15,17H2,1H3