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

Systemtic Name: 4-(4-methylphenyl)-4-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]but-2-enoic acid Openeye Name: 4-oxo-4-(p-tolyl)-2-[3-(trifluoromethyl)anilino]but-2-enoic acid CAS Name: 4-(4-methylphenyl)-4-oxo-2-[3-(trifluoromethyl)anilino]-2-butenoic acid IUPAC Name: 4-(4-methylphenyl)-4-oxo-2-[3-(trifluoromethyl)anilino]but-2-enoic acid Traditional Name: 4-keto-4-(p-tolyl)-2-[3-(trifluoromethyl)anilino]but-2-enoic acid Formula: C18H14F3NO3 MolecularWeight: 349.30387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=C(C(=O)O)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C=C(C(=O)O)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C18H14F3NO3/c1-11-5-7-12(8-6-11)16(23)10-15(17(24)25)22-14-4-2-3-13(9-14)18(19,20)21/h2-10,22H,1H3,(H,24,25)