sodium 1-(2-methylpropoxysulfonyl)naphthalene-2-sulfonate

Systemtic Name: sodium 1-(2-methylpropoxysulfonyl)naphthalene-2-sulfonate Openeye Name: sodium 1-isobutoxysulfonylnaphthalene-2-sulfonate CAS Name: sodium 1-(2-methylpropoxysulfonyl)-2-naphthalenesulfonate IUPAC Name: sodium 1-(2-methylpropoxysulfonyl)naphthalene-2-sulfonate Traditional Name: sodium 1-isobutoxysulfonylnaphthalene-2-sulfonate Formula: C14H15NaO6S2 MolecularWeight: 366.38507

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COS(=O)(=O)C1=C(C=CC2=CC=CC=C21)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(C)COS(=O)(=O)C1=C(C=CC2=CC=CC=C21)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C14H16O6S2.Na/c1-10(2)9-20-22(18,19)14-12-6-4-3-5-11(12)7-8-13(14)21(15,16)17;/h3-8,10H,9H2,1-2H3,(H,15,16,17);/q;+1/p-1