1-(4-fluorophenyl)carbonyl-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)carbonyl-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]piperidine-3-carboxamide Openeye Name: 1-(4-fluorobenzoyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]piperidine-3-carboxamide CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-fluorobenzoyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]piperidine-3-carboxamide Traditional Name: 1-(4-fluorobenzoyl)-N-[4-(3-ketopiperazino)benzyl]nipecotamide Formula: C24H27FN4O3 MolecularWeight: 438.494583

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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=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)F)C(=O)NCC3=CC=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C24H27FN4O3/c25-20-7-5-18(6-8-20)24(32)29-12-1-2-19(15-29)23(31)27-14-17-3-9-21(10-4-17)28-13-11-26-22(30)16-28/h3-10,19H,1-2,11-16H2,(H,26,30)(H,27,31)