(E)-4-oxidanylidene-4-[[4-(trifluoromethyloxy)phenyl]methylamino]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[[4-(trifluoromethyloxy)phenyl]methylamino]but-2-enoic acid Openeye Name: (E)-4-oxo-4-[[4-(trifluoromethoxy)phenyl]methylamino]but-2-enoic acid CAS Name: (E)-4-oxo-4-[[4-(trifluoromethoxy)phenyl]methylamino]-2-butenoic acid IUPAC Name: (E)-4-oxo-4-[[4-(trifluoromethoxy)phenyl]methylamino]but-2-enoic acid Traditional Name: (E)-4-keto-4-[[4-(trifluoromethoxy)benzyl]amino]but-2-enoic acid Formula: C12H10F3NO4 MolecularWeight: 289.20731

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C=CC(=O)O)OC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)/C=C/C(=O)O)OC(F)(F)F

InChI

InChI=1S/C12H10F3NO4/c13-12(14,15)20-9-3-1-8(2-4-9)7-16-10(17)5-6-11(18)19/h1-6H,7H2,(H,16,17)(H,18,19)/b6-5+