(E)-2-methoxycarbonyl-4-[3-(trifluoromethyl)phenyl]but-3-enoic acid

Systemtic Name: (E)-2-methoxycarbonyl-4-[3-(trifluoromethyl)phenyl]but-3-enoic acid Openeye Name: (E)-2-methoxycarbonyl-4-[3-(trifluoromethyl)phenyl]but-3-enoic acid CAS Name: (E)-2-methoxycarbonyl-4-[3-(trifluoromethyl)phenyl]-3-butenoic acid IUPAC Name: (E)-2-methoxycarbonyl-4-[3-(trifluoromethyl)phenyl]but-3-enoic acid Traditional Name: (E)-2-carbomethoxy-4-[3-(trifluoromethyl)phenyl]but-3-enoic acid Formula: C13H11F3O4 MolecularWeight: 288.21925

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=O)C(/C=C/C1=CC(=CC=C1)C(F)(F)F)C(=O)O

InChI

InChI=1S/C13H11F3O4/c1-20-12(19)10(11(17)18)6-5-8-3-2-4-9(7-8)13(14,15)16/h2-7,10H,1H3,(H,17,18)/b6-5+