1-[2-oxidanylidene-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-oxidanylidene-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-[4-[3-(trifluoromethyl)phenyl]piperazino]ethyl]piperidin-1-ium-4-carboxamide Formula: C19H26F3N4O2+ MolecularWeight: 399.43055

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25F3N4O2/c20-19(21,22)15-2-1-3-16(12-15)25-8-10-26(11-9-25)17(27)13-24-6-4-14(5-7-24)18(23)28/h1-3,12,14H,4-11,13H2,(H2,23,28)/p+1