1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-piperidin-1-yl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-piperidin-1-yl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]-4-(1-piperidyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethyl]-4-(1-piperidinyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl]-4-piperidin-1-ylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[2-[4-(4-fluorophenyl)piperazino]-2-keto-ethyl]-4-piperidino-piperidin-1-ium-4-carboxamide Formula: C23H35FN5O2+ MolecularWeight: 432.554703

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2(CC[NH+](CC2)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)F)C(=O)N

Isomeric SMILES

C1CCN(CC1)C2(CC[NH+](CC2)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)F)C(=O)N

InChI

InChI=1S/C23H34FN5O2/c24-19-4-6-20(7-5-19)27-14-16-28(17-15-27)21(30)18-26-12-8-23(9-13-26,22(25)31)29-10-2-1-3-11-29/h4-7H,1-3,8-18H2,(H2,25,31)/p+1