ethyl 3-[(4-fluorophenyl)methyl]-1-(3-methylphenyl)carbonyl-piperidine-3-carboxylate

Systemtic Name: ethyl 3-[(4-fluorophenyl)methyl]-1-(3-methylphenyl)carbonyl-piperidine-3-carboxylate Openeye Name: ethyl 3-[(4-fluorophenyl)methyl]-1-(3-methylbenzoyl)piperidine-3-carboxylate CAS Name: 3-[(4-fluorophenyl)methyl]-1-[(3-methylphenyl)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-fluorophenyl)methyl]-1-(3-methylbenzoyl)piperidine-3-carboxylate Traditional Name: 3-(4-fluorobenzyl)-1-m-toluoyl-nipecotic acid ethyl ester Formula: C23H26FNO3 MolecularWeight: 383.455843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC(=CC=C2)C)CC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC(=CC=C2)C)CC3=CC=C(C=C3)F

InChI

InChI=1S/C23H26FNO3/c1-3-28-22(27)23(15-18-8-10-20(24)11-9-18)12-5-13-25(16-23)21(26)19-7-4-6-17(2)14-19/h4,6-11,14H,3,5,12-13,15-16H2,1-2H3