1-[4-(4-fluorophenyl)piperazin-1-yl]-2-[4-(4-methylphenyl)carbonylpiperidin-1-ium-1-yl]ethanone

Systemtic Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-[4-(4-methylphenyl)carbonylpiperidin-1-ium-1-yl]ethanone Openeye Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-[4-(4-methylbenzoyl)piperidin-1-ium-1-yl]ethanone CAS Name: 1-[4-(4-fluorophenyl)-1-piperazinyl]-2-[4-[(4-methylphenyl)-oxomethyl]-1-piperidin-1-iumyl]ethanone IUPAC Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-[4-(4-methylbenzoyl)piperidin-1-ium-1-yl]ethanone Traditional Name: 1-[4-(4-fluorophenyl)piperazino]-2-(4-p-toluoylpiperidin-1-ium-1-yl)ethanone Formula: C25H31FN3O2+ MolecularWeight: 424.530943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2CC[NH+](CC2)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2CC[NH+](CC2)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H30FN3O2/c1-19-2-4-20(5-3-19)25(31)21-10-12-27(13-11-21)18-24(30)29-16-14-28(15-17-29)23-8-6-22(26)7-9-23/h2-9,21H,10-18H2,1H3/p+1