6-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-N-[(1S)-1-naphthalen-1-ylethyl]-2-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: 6-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-N-[(1S)-1-naphthalen-1-ylethyl]-2-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: 6-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-N-[(1S)-1-(1-naphthyl)ethyl]-2-oxo-1H-pyridine-3-carboxamide CAS Name: 6-[[4-(4-fluorophenyl)-1-piperazin-1-iumyl]methyl]-N-[(1S)-1-(1-naphthalenyl)ethyl]-2-oxo-1H-pyridine-3-carboxamide IUPAC Name: 6-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-N-[(1S)-1-naphthalen-1-ylethyl]-2-oxo-1H-pyridine-3-carboxamide Traditional Name: 6-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-2-keto-N-[(1S)-1-(1-naphthyl)ethyl]-1H-pyridine-3-carboxamide Formula: C29H30FN4O2+ MolecularWeight: 485.572503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=CC=C(NC3=O)C[NH+]4CCN(CC4)C5=CC=C(C=C5)F

Isomeric SMILES

C[C@@H](C1=CC=CC2=CC=CC=C21)NC(=O)C3=CC=C(NC3=O)C[NH+]4CCN(CC4)C5=CC=C(C=C5)F

InChI

InChI=1S/C29H29FN4O2/c1-20(25-8-4-6-21-5-2-3-7-26(21)25)31-28(35)27-14-11-23(32-29(27)36)19-33-15-17-34(18-16-33)24-12-9-22(30)10-13-24/h2-14,20H,15-19H2,1H3,(H,31,35)(H,32,36)/p+1/t20-/m0/s1