(Z)-3-[3,4-bis(oxidanyl)phenyl]sulfanyl-3-[2-(trifluoromethyl)phenyl]prop-2-enoic acid

Systemtic Name: (Z)-3-[3,4-bis(oxidanyl)phenyl]sulfanyl-3-[2-(trifluoromethyl)phenyl]prop-2-enoic acid Openeye Name: (Z)-3-(3,4-dihydroxyphenyl)sulfanyl-3-[2-(trifluoromethyl)phenyl]prop-2-enoic acid CAS Name: (Z)-3-[(3,4-dihydroxyphenyl)thio]-3-[2-(trifluoromethyl)phenyl]-2-propenoic acid IUPAC Name: (Z)-3-(3,4-dihydroxyphenyl)sulfanyl-3-[2-(trifluoromethyl)phenyl]prop-2-enoic acid Traditional Name: (Z)-3-[(3,4-dihydroxyphenyl)thio]-3-[2-(trifluoromethyl)phenyl]acrylic acid Formula: C16H11F3O4S MolecularWeight: 356.31635

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=CC(=O)O)SC2=CC(=C(C=C2)O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)/C(=C/C(=O)O)/SC2=CC(=C(C=C2)O)O)C(F)(F)F

InChI

InChI=1S/C16H11F3O4S/c17-16(18,19)11-4-2-1-3-10(11)14(8-15(22)23)24-9-5-6-12(20)13(21)7-9/h1-8,20-21H,(H,22,23)/b14-8-