1-(4-fluorophenyl)carbonyl-N-[[2-(phenoxymethyl)phenyl]methyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)carbonyl-N-[[2-(phenoxymethyl)phenyl]methyl]piperidine-3-carboxamide Openeye Name: 1-(4-fluorobenzoyl)-N-[[2-(phenoxymethyl)phenyl]methyl]piperidine-3-carboxamide CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-N-[[2-(phenoxymethyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-fluorobenzoyl)-N-[[2-(phenoxymethyl)phenyl]methyl]piperidine-3-carboxamide Traditional Name: 1-(4-fluorobenzoyl)-N-[2-(phenoxymethyl)benzyl]nipecotamide Formula: C27H27FN2O3 MolecularWeight: 446.513283

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)F)C(=O)NCC3=CC=CC=C3COC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)F)C(=O)NCC3=CC=CC=C3COC4=CC=CC=C4

InChI

InChI=1S/C27H27FN2O3/c28-24-14-12-20(13-15-24)27(32)30-16-6-9-22(18-30)26(31)29-17-21-7-4-5-8-23(21)19-33-25-10-2-1-3-11-25/h1-5,7-8,10-15,22H,6,9,16-19H2,(H,29,31)