sodium 4-methoxy-3-methoxycarbonyl-naphthalene-1-sulfonate

Systemtic Name: sodium 4-methoxy-3-methoxycarbonyl-naphthalene-1-sulfonate Openeye Name: sodium 4-methoxy-3-methoxycarbonyl-naphthalene-1-sulfonate CAS Name: sodium 4-methoxy-3-methoxycarbonyl-1-naphthalenesulfonate IUPAC Name: sodium 4-methoxy-3-methoxycarbonylnaphthalene-1-sulfonate Traditional Name: sodium 3-carbomethoxy-4-methoxy-naphthalene-1-sulfonate Formula: C13H11NaO6S MolecularWeight: 318.27761

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C2=CC=CC=C21)S(=O)(=O)[O-])C(=O)OC.[Na+]

Isomeric SMILES

COC1=C(C=C(C2=CC=CC=C21)S(=O)(=O)[O-])C(=O)OC.[Na+]

InChI

InChI=1S/C13H12O6S.Na/c1-18-12-9-6-4-3-5-8(9)11(20(15,16)17)7-10(12)13(14)19-2;/h3-7H,1-2H3,(H,15,16,17);/q;+1/p-1