2-[(3Z)-7-fluoranyl-2-methyl-3-[(4-methylsulfanylphenyl)methylidene]inden-1-yl]ethanoic acid

Systemtic Name: 2-[(3Z)-7-fluoranyl-2-methyl-3-[(4-methylsulfanylphenyl)methylidene]inden-1-yl]ethanoic acid Openeye Name: 2-[(3Z)-7-fluoro-2-methyl-3-[(4-methylsulfanylphenyl)methylene]inden-1-yl]acetic acid CAS Name: 2-[(3Z)-7-fluoro-2-methyl-3-[[4-(methylthio)phenyl]methylidene]-1-indenyl]acetic acid IUPAC Name: 2-[(3Z)-7-fluoro-2-methyl-3-[(4-methylsulfanylphenyl)methylidene]inden-1-yl]acetic acid Traditional Name: 2-[(3Z)-7-fluoro-2-methyl-3-[4-(methylthio)benzylidene]inden-1-yl]acetic acid Formula: C20H17FO2S MolecularWeight: 340.411183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1=CC3=CC=C(C=C3)SC)C=CC=C2F)CC(=O)O

Isomeric SMILES

CC\1=C(C2=C(/C1=C\C3=CC=C(C=C3)SC)C=CC=C2F)CC(=O)O

InChI

InChI=1S/C20H17FO2S/c1-12-16(10-13-6-8-14(24-2)9-7-13)15-4-3-5-18(21)20(15)17(12)11-19(22)23/h3-10H,11H2,1-2H3,(H,22,23)/b16-10-