2-[(3E)-6-fluoranyl-3-[(4-methylsulfinylphenyl)methylidene]inden-1-yl]propanoic acid

Systemtic Name: 2-[(3E)-6-fluoranyl-3-[(4-methylsulfinylphenyl)methylidene]inden-1-yl]propanoic acid Openeye Name: 2-[(3E)-6-fluoro-3-[(4-methylsulfinylphenyl)methylene]inden-1-yl]propanoic acid CAS Name: 2-[(3E)-6-fluoro-3-[(4-methylsulfinylphenyl)methylidene]-1-indenyl]propanoic acid IUPAC Name: 2-[(3E)-6-fluoro-3-[(4-methylsulfinylphenyl)methylidene]inden-1-yl]propanoic acid Traditional Name: 2-[(3E)-6-fluoro-3-(4-methylsulfinylbenzylidene)inden-1-yl]propionic acid Formula: C20H17FO3S MolecularWeight: 356.410583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC2=CC=C(C=C2)S(=O)C)C3=C1C=C(C=C3)F)C(=O)O

Isomeric SMILES

CC(C1=C/C(=C\C2=CC=C(C=C2)S(=O)C)/C3=C1C=C(C=C3)F)C(=O)O

InChI

InChI=1S/C20H17FO3S/c1-12(20(22)23)18-10-14(17-8-5-15(21)11-19(17)18)9-13-3-6-16(7-4-13)25(2)24/h3-12H,1-2H3,(H,22,23)/b14-9+