sodium 3-methoxy-4-naphthalen-2-ylsulfonyloxy-benzenesulfonate

Systemtic Name: sodium 3-methoxy-4-naphthalen-2-ylsulfonyloxy-benzenesulfonate Openeye Name: sodium 3-methoxy-4-(2-naphthylsulfonyloxy)benzenesulfonate CAS Name: sodium 3-methoxy-4-(2-naphthalenylsulfonyloxy)benzenesulfonate IUPAC Name: sodium 3-methoxy-4-naphthalen-2-ylsulfonyloxybenzenesulfonate Traditional Name: sodium 3-methoxy-4-(2-naphthylsulfonyloxy)besylate Formula: C17H13NaO7S2 MolecularWeight: 416.40069

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)S(=O)(=O)[O-])OS(=O)(=O)C2=CC3=CC=CC=C3C=C2.[Na+]

Isomeric SMILES

COC1=C(C=CC(=C1)S(=O)(=O)[O-])OS(=O)(=O)C2=CC3=CC=CC=C3C=C2.[Na+]

InChI

InChI=1S/C17H14O7S2.Na/c1-23-17-11-14(25(18,19)20)8-9-16(17)24-26(21,22)15-7-6-12-4-2-3-5-13(12)10-15;/h2-11H,1H3,(H,18,19,20);/q;+1/p-1