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

Systemtic Name: 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate Openeye Name: 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethyl]-4-piperidin-1-iumcarboxylate IUPAC Name: 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-[4-(4-fluorophenyl)piperazino]-2-keto-ethyl]piperidin-1-ium-4-carboxylate Formula: C18H24FN3O3 MolecularWeight: 349.399863

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)[O-])CC(=O)N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

C1C[NH+](CCC1C(=O)[O-])CC(=O)N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H24FN3O3/c19-15-1-3-16(4-2-15)21-9-11-22(12-10-21)17(23)13-20-7-5-14(6-8-20)18(24)25/h1-4,14H,5-13H2,(H,24,25)