disodium 2-(dimethylamino)-5-[4-(dimethylamino)benzene-5-id-1-yl]carbonyl-benzenesulfonate

Systemtic Name: disodium 2-(dimethylamino)-5-[4-(dimethylamino)benzene-5-id-1-yl]carbonyl-benzenesulfonate Openeye Name: disodium 2-(dimethylamino)-5-[4-(dimethylamino)benzene-5-ide-1-carbonyl]benzenesulfonate CAS Name: disodium 2-(dimethylamino)-5-[[4-(dimethylamino)-1-benzene-5-idyl]-oxomethyl]benzenesulfonate IUPAC Name: disodium 2-(dimethylamino)-5-[4-(dimethylamino)benzene-5-ide-1-carbonyl]benzenesulfonate Traditional Name: disodium 2-(dimethylamino)-5-[4-(dimethylamino)benzene-5-ide-1-carbonyl]besylate Formula: C17H18N2Na2O4S MolecularWeight: 392.38036

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)C2=CC=C([C-]=C2)N(C)C)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)C2=CC=C([C-]=C2)N(C)C)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C17H19N2O4S.2Na/c1-18(2)14-8-5-12(6-9-14)17(20)13-7-10-15(19(3)4)16(11-13)24(21,22)23;;/h5-8,10-11H,1-4H3,(H,21,22,23);;/q-1;2*+1/p-1