trisodium (4Z)-4-oxidanidylimino-3-oxidanylidene-naphthalene-2,7-disulfonate

Systemtic Name: trisodium (4Z)-4-oxidanidylimino-3-oxidanylidene-naphthalene-2,7-disulfonate Openeye Name: trisodium (4Z)-4-oxidoimino-3-oxo-naphthalene-2,7-disulfonate CAS Name: trisodium (4Z)-4-oxidoimino-3-oxonaphthalene-2,7-disulfonate IUPAC Name: trisodium (4Z)-4-oxidoimino-3-oxonaphthalene-2,7-disulfonate Traditional Name: trisodium (4Z)-3-keto-4-oxidoimino-naphthalene-2,7-disulfonate Formula: C10H4NNa3O8S2 MolecularWeight: 399.23997

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)[O-])C=C(C(=O)C2=N[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC\2=C(C=C1S(=O)(=O)[O-])C=C(C(=O)/C2=N\[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C10H7NO8S2.3Na/c12-10-8(21(17,18)19)4-5-3-6(20(14,15)16)1-2-7(5)9(10)11-13;;;/h1-4,13H,(H,14,15,16)(H,17,18,19);;;/q;3*+1/p-3/b11-9-;;;