6,7-bis(oxidanyl)naphthalene-2-sulfonic acid; 6,7-dimethoxynaphthalene-2-sulfonyl chloride

Systemtic Name: 6,7-bis(oxidanyl)naphthalene-2-sulfonic acid; 6,7-dimethoxynaphthalene-2-sulfonyl chloride Openeye Name: 6,7-dihydroxynaphthalene-2-sulfonic acid; 6,7-dimethoxynaphthalene-2-sulfonyl chloride CAS Name: 6,7-dihydroxy-2-naphthalenesulfonic acid; 6,7-dimethoxy-2-naphthalenesulfonyl chloride IUPAC Name: 6,7-dihydroxynaphthalene-2-sulfonic acid; 6,7-dimethoxynaphthalene-2-sulfonyl chloride Traditional Name: 6,7-dihydroxynaphthalene-2-sulfonic acid; 6,7-dimethoxynaphthalene-2-sulfonyl chloride Formula: C22H19ClO9S2 MolecularWeight: 526.96386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=C(C=CC2=C1)S(=O)(=O)Cl)OC.C1=CC(=CC2=CC(=C(C=C21)O)O)S(=O)(=O)O

Isomeric SMILES

COC1=C(C=C2C=C(C=CC2=C1)S(=O)(=O)Cl)OC.C1=CC(=CC2=CC(=C(C=C21)O)O)S(=O)(=O)O

InChI

InChI=1S/C12H11ClO4S.C10H8O5S/c1-16-11-6-8-3-4-10(18(13,14)15)5-9(8)7-12(11)17-2;11-9-4-6-1-2-8(16(13,14)15)3-7(6)5-10(9)12/h3-7H,1-2H3;1-5,11-12H,(H,13,14,15)