disodium (3Z)-5-oxidanyl-4-oxidanylidene-3-(1,3-thiazol-2-ylhydrazinylidene)naphthalene-2,7-disulfonate

Systemtic Name: disodium (3Z)-5-oxidanyl-4-oxidanylidene-3-(1,3-thiazol-2-ylhydrazinylidene)naphthalene-2,7-disulfonate Openeye Name: disodium (3Z)-5-hydroxy-4-oxo-3-(thiazol-2-ylhydrazono)naphthalene-2,7-disulfonate CAS Name: disodium (3Z)-5-hydroxy-4-oxo-3-(2-thiazolylhydrazinylidene)naphthalene-2,7-disulfonate IUPAC Name: disodium (3Z)-5-hydroxy-4-oxo-3-(1,3-thiazol-2-ylhydrazinylidene)naphthalene-2,7-disulfonate Traditional Name: disodium (3Z)-5-hydroxy-4-keto-3-(thiazol-2-ylhydrazono)naphthalene-2,7-disulfonate Formula: C13H7N3Na2O8S3 MolecularWeight: 475.38452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=N1)NN=C2C(=CC3=CC(=CC(=C3C2=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CSC(=N1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C13H9N3O8S3.2Na/c17-8-5-7(26(19,20)21)3-6-4-9(27(22,23)24)11(12(18)10(6)8)15-16-13-14-1-2-25-13;;/h1-5,17H,(H,14,16)(H,19,20,21)(H,22,23,24);;/q;2*+1/p-2/b15-11+;;