N-[2-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]-N-methyl-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[2-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]-N-methyl-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-ethyl]-N-methyl-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl]-N-methyl-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl]-N-methyl-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-keto-ethyl]-N-methyl-2-piperidin-1-ium-1-yl-acetamide Formula: C17H22ClF3N3O2+ MolecularWeight: 392.82369

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=C(C=C1)Cl)C(F)(F)F)C(=O)C[NH+]2CCCCC2

Isomeric SMILES

CN(CC(=O)NC1=CC(=C(C=C1)Cl)C(F)(F)F)C(=O)C[NH+]2CCCCC2

InChI

InChI=1S/C17H21ClF3N3O2/c1-23(16(26)11-24-7-3-2-4-8-24)10-15(25)22-12-5-6-14(18)13(9-12)17(19,20)21/h5-6,9H,2-4,7-8,10-11H2,1H3,(H,22,25)/p+1