sodium 2,4-bis(methoxycarbonyl)-6-naphthalen-2-yloxysulfonyl-benzene-5-ide-1-sulfonic acid

Systemtic Name: sodium 2,4-bis(methoxycarbonyl)-6-naphthalen-2-yloxysulfonyl-benzene-5-ide-1-sulfonic acid Openeye Name: sodium 2,4-bis(methoxycarbonyl)-6-(2-naphthyloxysulfonyl)benzene-5-ide-1-sulfonic acid CAS Name: sodium 2,4-bis(methoxycarbonyl)-6-(2-naphthalenyloxysulfonyl)-1-benzene-5-idesulfonic acid IUPAC Name: sodium 2,4-bis(methoxycarbonyl)-6-naphthalen-2-yloxysulfonylbenzene-5-ide-1-sulfonic acid Traditional Name: sodium 2,4-dicarbomethoxy-6-(2-naphthoxysulfonyl)benzene-5-ide-1-sulfonic acid Formula: C20H15NaO10S2 MolecularWeight: 502.44687

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=[C-]C(=C1S(=O)(=O)O)S(=O)(=O)OC2=CC3=CC=CC=C3C=C2)C(=O)OC.[Na+]

Isomeric SMILES

COC(=O)C1=CC(=[C-]C(=C1S(=O)(=O)O)S(=O)(=O)OC2=CC3=CC=CC=C3C=C2)C(=O)OC.[Na+]

InChI

InChI=1S/C20H15O10S2.Na/c1-28-19(21)14-10-16(20(22)29-2)18(31(23,24)25)17(11-14)32(26,27)30-15-8-7-12-5-3-4-6-13(12)9-15;/h3-10H,1-2H3,(H,23,24,25);/q-1;+1