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

Systemtic Name: [2-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl] 1-oxidanidylpyridin-1-ium-4-carboxylate Openeye Name: [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-ethyl] 1-oxidopyridin-1-ium-4-carboxylate CAS Name: 1-oxido-4-pyridin-1-iumcarboxylic acid [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate Traditional Name: 1-oxidopyridin-1-ium-4-carboxylic acid [2-[4-chloro-3-(trifluoromethyl)anilino]-2-keto-ethyl] ester Formula: C15H10ClF3N2O4 MolecularWeight: 374.69911

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)COC(=O)C2=CC=[N+](C=C2)[O-])C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)COC(=O)C2=CC=[N+](C=C2)[O-])C(F)(F)F)Cl

InChI

InChI=1S/C15H10ClF3N2O4/c16-12-2-1-10(7-11(12)15(17,18)19)20-13(22)8-25-14(23)9-3-5-21(24)6-4-9/h1-7H,8H2,(H,20,22)