(Z)-3-[3,5-bis(trifluoromethyl)phenyl]but-2-enoic acid

Systemtic Name: (Z)-3-[3,5-bis(trifluoromethyl)phenyl]but-2-enoic acid Openeye Name: (Z)-3-[3,5-bis(trifluoromethyl)phenyl]but-2-enoic acid CAS Name: (Z)-3-[3,5-bis(trifluoromethyl)phenyl]-2-butenoic acid IUPAC Name: (Z)-3-[3,5-bis(trifluoromethyl)phenyl]but-2-enoic acid Traditional Name: (Z)-3-[3,5-bis(trifluoromethyl)phenyl]but-2-enoic acid Formula: C12H8F6O2 MolecularWeight: 298.181139

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8F6O2/c1-6(2-10(19)20)7-3-8(11(13,14)15)5-9(4-7)12(16,17)18/h2-5H,1H3,(H,19,20)/b6-2-