disodium 4-oxidanyl-6-[(3-sulfonatophenyl)amino]naphthalene-2-sulfonate

Systemtic Name: disodium 4-oxidanyl-6-[(3-sulfonatophenyl)amino]naphthalene-2-sulfonate Openeye Name: disodium 4-hydroxy-6-(3-sulfonatoanilino)naphthalene-2-sulfonate CAS Name: disodium 4-hydroxy-6-(3-sulfonatoanilino)-2-naphthalenesulfonate IUPAC Name: disodium 4-hydroxy-6-(3-sulfonatoanilino)naphthalene-2-sulfonate Traditional Name: disodium 4-hydroxy-6-(3-sulfonatoanilino)naphthalene-2-sulfonate Formula: C16H11NNa2O7S2 MolecularWeight: 439.37058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)[O-])NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])O.[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)[O-])NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])O.[Na+].[Na+]

InChI

InChI=1S/C16H13NO7S2.2Na/c18-16-9-14(26(22,23)24)6-10-4-5-12(8-15(10)16)17-11-2-1-3-13(7-11)25(19,20)21;;/h1-9,17-18H,(H,19,20,21)(H,22,23,24);;/q;2*+1/p-2