(3Z)-4-oxidanylidene-3-(3H-1,2,4-triazol-5-ylhydrazinylidene)naphthalene-1,5-disulfonic acid

Systemtic Name: (3Z)-4-oxidanylidene-3-(3H-1,2,4-triazol-5-ylhydrazinylidene)naphthalene-1,5-disulfonic acid Openeye Name: (3Z)-4-oxo-3-(3H-1,2,4-triazol-5-ylhydrazono)naphthalene-1,5-disulfonic acid CAS Name: (3Z)-4-oxo-3-(3H-1,2,4-triazol-5-ylhydrazinylidene)naphthalene-1,5-disulfonic acid IUPAC Name: (3Z)-4-oxo-3-(3H-1,2,4-triazol-5-ylhydrazinylidene)naphthalene-1,5-disulfonic acid Traditional Name: (3Z)-4-keto-3-(3H-1,2,4-triazol-5-ylhydrazono)naphthalene-1,5-disulfonic acid Formula: C12H9N5O7S2 MolecularWeight: 399.35916

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Descriptors Computed from Structure

Canonical SMILES:

C1N=C(N=N1)NN=C2C=C(C3=C(C2=O)C(=CC=C3)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1N=C(N=N1)N/N=C\2/C=C(C3=C(C2=O)C(=CC=C3)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C12H9N5O7S2/c18-11-7(15-17-12-13-5-14-16-12)4-9(26(22,23)24)6-2-1-3-8(10(6)11)25(19,20)21/h1-4H,5H2,(H,13,17)(H,19,20,21)(H,22,23,24)/b15-7-