2-[6-chloranyl-4-[(4-methylsulfonylphenyl)-oxidanyl-methyl]naphthalen-2-yl]ethanoic acid

Systemtic Name: 2-[6-chloranyl-4-[(4-methylsulfonylphenyl)-oxidanyl-methyl]naphthalen-2-yl]ethanoic acid Openeye Name: 2-[6-chloro-4-[hydroxy-(4-methylsulfonylphenyl)methyl]-2-naphthyl]acetic acid CAS Name: 2-[6-chloro-4-[hydroxy-(4-methylsulfonylphenyl)methyl]-2-naphthalenyl]acetic acid IUPAC Name: 2-[6-chloro-4-[hydroxy-(4-methylsulfonylphenyl)methyl]naphthalen-2-yl]acetic acid Traditional Name: 2-[6-chloro-4-[hydroxy-(4-mesylphenyl)methyl]-2-naphthyl]acetic acid Formula: C20H17ClO5S MolecularWeight: 404.86398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17ClO5S/c1-27(25,26)16-6-3-13(4-7-16)20(24)18-9-12(10-19(22)23)8-14-2-5-15(21)11-17(14)18/h2-9,11,20,24H,10H2,1H3,(H,22,23)