2-methyl-5-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]furan-3-carboxylic acid

Systemtic Name: 2-methyl-5-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]furan-3-carboxylic acid Openeye Name: 2-methyl-5-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]furan-3-carboxylic acid CAS Name: 2-methyl-5-[[[3-(trifluoromethyl)phenyl]thio]methyl]-3-furancarboxylic acid IUPAC Name: 2-methyl-5-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]furan-3-carboxylic acid Traditional Name: 2-methyl-5-[[[3-(trifluoromethyl)phenyl]thio]methyl]-3-furoic acid Formula: C14H11F3O3S MolecularWeight: 316.29555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=CC=CC(=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CSC2=CC=CC(=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C14H11F3O3S/c1-8-12(13(18)19)6-10(20-8)7-21-11-4-2-3-9(5-11)14(15,16)17/h2-6H,7H2,1H3,(H,18,19)