sodium 5-[bis(methylsulfonyl)amino]-1-methylsulfonyloxy-naphthalene-2-sulfonate

Systemtic Name: sodium 5-[bis(methylsulfonyl)amino]-1-methylsulfonyloxy-naphthalene-2-sulfonate Openeye Name: sodium 5-[bis(methylsulfonyl)amino]-1-methylsulfonyloxy-naphthalene-2-sulfonate CAS Name: sodium 5-[bis(methylsulfonyl)amino]-1-methylsulfonyloxy-2-naphthalenesulfonate IUPAC Name: sodium 5-[bis(methylsulfonyl)amino]-1-methylsulfonyloxynaphthalene-2-sulfonate Traditional Name: sodium 5-(dimesylamino)-1-methylsulfonyloxy-naphthalene-2-sulfonate Formula: C13H14NNaO10S4 MolecularWeight: 495.50073

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(C1=CC=CC2=C1C=CC(=C2OS(=O)(=O)C)S(=O)(=O)[O-])S(=O)(=O)C.[Na+]

Isomeric SMILES

CS(=O)(=O)N(C1=CC=CC2=C1C=CC(=C2OS(=O)(=O)C)S(=O)(=O)[O-])S(=O)(=O)C.[Na+]

InChI

InChI=1S/C13H15NO10S4.Na/c1-25(15,16)14(26(2,17)18)11-6-4-5-10-9(11)7-8-12(28(21,22)23)13(10)24-27(3,19)20;/h4-8H,1-3H3,(H,21,22,23);/q;+1/p-1