1-[2-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-keto-ethyl]pyridin-1-ium-3-carboxamide Formula: C15H12ClF3N3O2+ MolecularWeight: 358.72289

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)C(=O)N

Isomeric SMILES

C1=CC(=C[N+](=C1)CC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)C(=O)N

InChI

InChI=1S/C15H11ClF3N3O2/c16-12-4-3-10(6-11(12)15(17,18)19)21-13(23)8-22-5-1-2-9(7-22)14(20)24/h1-7H,8H2,(H2-,20,21,23,24)/p+1