(E)-4-[[4-cyano-3-(trifluoromethyl)phenyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[4-cyano-3-(trifluoromethyl)phenyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[4-cyano-3-(trifluoromethyl)anilino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[4-cyano-3-(trifluoromethyl)anilino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[4-cyano-3-(trifluoromethyl)anilino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[4-cyano-3-(trifluoromethyl)anilino]-4-keto-but-2-enoic acid Formula: C12H7F3N2O3 MolecularWeight: 284.19079

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)C=CC(=O)O)C(F)(F)F)C#N

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)/C=C/C(=O)O)C(F)(F)F)C#N

InChI

InChI=1S/C12H7F3N2O3/c13-12(14,15)9-5-8(2-1-7(9)6-16)17-10(18)3-4-11(19)20/h1-5H,(H,17,18)(H,19,20)/b4-3+