(E)-4-[[2-methyl-5-(trifluoromethyl)phenyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[2-methyl-5-(trifluoromethyl)phenyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[2-methyl-5-(trifluoromethyl)anilino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[2-methyl-5-(trifluoromethyl)anilino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[2-methyl-5-(trifluoromethyl)anilino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[2-methyl-5-(trifluoromethyl)anilino]but-2-enoic acid Formula: C12H10F3NO3 MolecularWeight: 273.20791

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(F)(F)F)NC(=O)C=CC(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(F)(F)F)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C12H10F3NO3/c1-7-2-3-8(12(13,14)15)6-9(7)16-10(17)4-5-11(18)19/h2-6H,1H3,(H,16,17)(H,18,19)/b5-4+