2-[(3Z)-6-fluoranyl-2-methyl-3-[methylsulfinyl(phenyl)methylidene]inden-1-yl]propanoic acid

Systemtic Name: 2-[(3Z)-6-fluoranyl-2-methyl-3-[methylsulfinyl(phenyl)methylidene]inden-1-yl]propanoic acid Openeye Name: 2-[(3Z)-6-fluoro-2-methyl-3-[methylsulfinyl(phenyl)methylene]inden-1-yl]propanoic acid CAS Name: 2-[(3Z)-6-fluoro-2-methyl-3-[methylsulfinyl(phenyl)methylidene]-1-indenyl]propanoic acid IUPAC Name: 2-[(3Z)-6-fluoro-2-methyl-3-[methylsulfinyl(phenyl)methylidene]inden-1-yl]propanoic acid Traditional Name: 2-[(3Z)-6-fluoro-2-methyl-3-[methylsulfinyl(phenyl)methylene]inden-1-yl]propionic acid Formula: C21H19FO3S MolecularWeight: 370.437163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1=C(C3=CC=CC=C3)S(=O)C)C=CC(=C2)F)C(C)C(=O)O

Isomeric SMILES

CC\1=C(C2=C(/C1=C(/C3=CC=CC=C3)\S(=O)C)C=CC(=C2)F)C(C)C(=O)O

InChI

InChI=1S/C21H19FO3S/c1-12-18(13(2)21(23)24)17-11-15(22)9-10-16(17)19(12)20(26(3)25)14-7-5-4-6-8-14/h4-11,13H,1-3H3,(H,23,24)/b20-19-