1-ethyl-4-[(3-fluorophenyl)carbonyl-propyl-amino]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-ethyl-4-[(3-fluorophenyl)carbonyl-propyl-amino]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-ethyl-4-[(3-fluorobenzoyl)-propyl-amino]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-ethyl-4-[[(3-fluorophenyl)-oxomethyl]-propylamino]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-ethyl-4-[(3-fluorobenzoyl)-propylamino]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-ethyl-4-[(3-fluorobenzoyl)-propyl-amino]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C24H31FN3O2+ MolecularWeight: 412.520243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(=O)C1=CC(=CC=C1)F)C2(CC[NH+](CC2)CC)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCN(C(=O)C1=CC(=CC=C1)F)C2(CC[NH+](CC2)CC)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C24H30FN3O2/c1-3-15-28(22(29)19-9-8-10-20(25)18-19)24(13-16-27(4-2)17-14-24)23(30)26-21-11-6-5-7-12-21/h5-12,18H,3-4,13-17H2,1-2H3,(H,26,30)/p+1