sodium 1-[6,7-bis(oxidanyl)naphthalen-2-yl]sulfonyloxynaphthalene-2-carboxylic acid

Systemtic Name: sodium 1-[6,7-bis(oxidanyl)naphthalen-2-yl]sulfonyloxynaphthalene-2-carboxylic acid Openeye Name: sodium 1-[(6,7-dihydroxy-2-naphthyl)sulfonyloxy]naphthalene-2-carboxylic acid CAS Name: sodium 1-[(6,7-dihydroxy-2-naphthalenyl)sulfonyloxy]-2-naphthalenecarboxylic acid IUPAC Name: sodium 1-(6,7-dihydroxynaphthalen-2-yl)sulfonyloxynaphthalene-2-carboxylic acid Traditional Name: sodium 1-[(6,7-dihydroxy-2-naphthyl)sulfonyloxy]-2-naphthoic acid Formula: C21H14NaO7S+ MolecularWeight: 433.38643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2OS(=O)(=O)C3=CC4=CC(=C(C=C4C=C3)O)O)C(=O)O.[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2OS(=O)(=O)C3=CC4=CC(=C(C=C4C=C3)O)O)C(=O)O.[Na+]

InChI

InChI=1S/C21H14O7S.Na/c22-18-10-13-5-7-15(9-14(13)11-19(18)23)29(26,27)28-20-16-4-2-1-3-12(16)6-8-17(20)21(24)25;/h1-11,22-23H,(H,24,25);/q;+1