2-[6,7-bis(fluoranyl)-4-(4-methylsulfonylphenyl)carbonyl-naphthalen-2-yl]ethanoic acid

Systemtic Name: 2-[6,7-bis(fluoranyl)-4-(4-methylsulfonylphenyl)carbonyl-naphthalen-2-yl]ethanoic acid Openeye Name: 2-[6,7-difluoro-4-(4-methylsulfonylbenzoyl)-2-naphthyl]acetic acid CAS Name: 2-[6,7-difluoro-4-[(4-methylsulfonylphenyl)-oxomethyl]-2-naphthalenyl]acetic acid IUPAC Name: 2-[6,7-difluoro-4-(4-methylsulfonylbenzoyl)naphthalen-2-yl]acetic acid Traditional Name: 2-[6,7-difluoro-4-(4-mesylbenzoyl)-2-naphthyl]acetic acid Formula: C20H14F2O5S MolecularWeight: 404.383966

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)C2=C3C=C(C(=CC3=CC(=C2)CC(=O)O)F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)C2=C3C=C(C(=CC3=CC(=C2)CC(=O)O)F)F

InChI

InChI=1S/C20H14F2O5S/c1-28(26,27)14-4-2-12(3-5-14)20(25)16-7-11(8-19(23)24)6-13-9-17(21)18(22)10-15(13)16/h2-7,9-10H,8H2,1H3,(H,23,24)