(3S)-1-(4-fluorophenyl)carbonyl-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-fluorophenyl)carbonyl-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(4-fluorobenzoyl)-N-(p-tolylmethyl)piperidine-3-carboxamide CAS Name: (3S)-1-[(4-fluorophenyl)-oxomethyl]-N-[(4-methylphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-fluorobenzoyl)-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(4-fluorobenzoyl)-N-(4-methylbenzyl)nipecotamide Formula: C21H23FN2O2 MolecularWeight: 354.417923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)[C@H]2CCCN(C2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN2O2/c1-15-4-6-16(7-5-15)13-23-20(25)18-3-2-12-24(14-18)21(26)17-8-10-19(22)11-9-17/h4-11,18H,2-3,12-14H2,1H3,(H,23,25)/t18-/m0/s1