2-[6-fluoranyl-2-methyl-4-[1-(4-methylsulfinylphenyl)ethyl]-3H-inden-1-yl]ethanoic acid

Systemtic Name: 2-[6-fluoranyl-2-methyl-4-[1-(4-methylsulfinylphenyl)ethyl]-3H-inden-1-yl]ethanoic acid Openeye Name: 2-[6-fluoro-2-methyl-4-[1-(4-methylsulfinylphenyl)ethyl]-3H-inden-1-yl]acetic acid CAS Name: 2-[6-fluoro-2-methyl-4-[1-(4-methylsulfinylphenyl)ethyl]-3H-inden-1-yl]acetic acid IUPAC Name: 2-[6-fluoro-2-methyl-4-[1-(4-methylsulfinylphenyl)ethyl]-3H-inden-1-yl]acetic acid Traditional Name: 2-[6-fluoro-2-methyl-4-[1-(4-methylsulfinylphenyl)ethyl]-3H-inden-1-yl]acetic acid Formula: C21H21FO3S MolecularWeight: 372.453043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=CC(=C2C1)C(C)C3=CC=C(C=C3)S(=O)C)F)CC(=O)O

Isomeric SMILES

CC1=C(C2=CC(=CC(=C2C1)C(C)C3=CC=C(C=C3)S(=O)C)F)CC(=O)O

InChI

InChI=1S/C21H21FO3S/c1-12-8-19-18(9-15(22)10-20(19)17(12)11-21(23)24)13(2)14-4-6-16(7-5-14)26(3)25/h4-7,9-10,13H,8,11H2,1-3H3,(H,23,24)