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

Systemtic Name: 4-[(3-fluorophenyl)carbonyl-propyl-amino]-N-phenyl-1-propyl-piperidin-1-ium-4-carboxamide Openeye Name: 4-[(3-fluorobenzoyl)-propyl-amino]-N-phenyl-1-propyl-piperidin-1-ium-4-carboxamide CAS Name: 4-[[(3-fluorophenyl)-oxomethyl]-propylamino]-N-phenyl-1-propyl-4-piperidin-1-iumcarboxamide IUPAC Name: 4-[(3-fluorobenzoyl)-propylamino]-N-phenyl-1-propylpiperidin-1-ium-4-carboxamide Traditional Name: 4-[(3-fluorobenzoyl)-propyl-amino]-N-phenyl-1-propyl-piperidin-1-ium-4-carboxamide Formula: C25H33FN3O2+ MolecularWeight: 426.546823

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)(C(=O)NC2=CC=CC=C2)N(CCC)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCC[NH+]1CCC(CC1)(C(=O)NC2=CC=CC=C2)N(CCC)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C25H32FN3O2/c1-3-15-28-17-13-25(14-18-28,24(31)27-22-11-6-5-7-12-22)29(16-4-2)23(30)20-9-8-10-21(26)19-20/h5-12,19H,3-4,13-18H2,1-2H3,(H,27,31)/p+1