2-(5-bromanylnaphthalen-2-yl)sulfonyl-6-methoxycarbonyl-benzoic acid

Systemtic Name: 2-(5-bromanylnaphthalen-2-yl)sulfonyl-6-methoxycarbonyl-benzoic acid Openeye Name: 2-[(5-bromo-2-naphthyl)sulfonyl]-6-methoxycarbonyl-benzoic acid CAS Name: 2-[(5-bromo-2-naphthalenyl)sulfonyl]-6-methoxycarbonylbenzoic acid IUPAC Name: 2-(5-bromonaphthalen-2-yl)sulfonyl-6-methoxycarbonylbenzoic acid Traditional Name: 2-[(5-bromo-2-naphthyl)sulfonyl]-6-carbomethoxy-benzoic acid Formula: C19H13BrO6S MolecularWeight: 449.27192

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)C(=CC=C3)Br)C(=O)O

Isomeric SMILES

COC(=O)C1=C(C(=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)C(=CC=C3)Br)C(=O)O

InChI

InChI=1S/C19H13BrO6S/c1-26-19(23)14-5-3-7-16(17(14)18(21)22)27(24,25)12-8-9-13-11(10-12)4-2-6-15(13)20/h2-10H,1H3,(H,21,22)