sodium 6-(4-methylphenyl)sulfonyloxynaphthalene-2-sulfonate

Systemtic Name: sodium 6-(4-methylphenyl)sulfonyloxynaphthalene-2-sulfonate Openeye Name: sodium 6-(p-tolylsulfonyloxy)naphthalene-2-sulfonate CAS Name: sodium 6-(4-methylphenyl)sulfonyloxy-2-naphthalenesulfonate IUPAC Name: sodium 6-(4-methylphenyl)sulfonyloxynaphthalene-2-sulfonate Traditional Name: sodium 6-tosyloxynaphthalene-2-sulfonate Formula: C17H13NaO6S2 MolecularWeight: 400.40129

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C=C(C=C3)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C=C(C=C3)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C17H14O6S2.Na/c1-12-2-7-16(8-3-12)25(21,22)23-15-6-4-14-11-17(24(18,19)20)9-5-13(14)10-15;/h2-11H,1H3,(H,18,19,20);/q;+1/p-1