(7E)-8-oxidanylidene-7-(1H-1,2,4-triazol-5-ylhydrazinylidene)naphthalene-1,3,6-trisulfonic acid

Systemtic Name: (7E)-8-oxidanylidene-7-(1H-1,2,4-triazol-5-ylhydrazinylidene)naphthalene-1,3,6-trisulfonic acid Openeye Name: (7E)-8-oxo-7-(1H-1,2,4-triazol-5-ylhydrazono)naphthalene-1,3,6-trisulfonic acid CAS Name: (7E)-8-oxo-7-(1H-1,2,4-triazol-5-ylhydrazinylidene)naphthalene-1,3,6-trisulfonic acid IUPAC Name: (7E)-8-oxo-7-(1H-1,2,4-triazol-5-ylhydrazinylidene)naphthalene-1,3,6-trisulfonic acid Traditional Name: (7E)-8-keto-7-(1H-1,2,4-triazol-5-ylhydrazono)naphthalene-1,3,6-trisulfonic acid Formula: C12H9N5O10S3 MolecularWeight: 479.42236

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C=C(C(=NNC3=NC=NN3)C(=O)C2=C(C=C1S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=C2C=C(/C(=N/NC3=NC=NN3)/C(=O)C2=C(C=C1S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C12H9N5O10S3/c18-11-9-5(1-6(28(19,20)21)3-7(9)29(22,23)24)2-8(30(25,26)27)10(11)15-17-12-13-4-14-16-12/h1-4H,(H,19,20,21)(H,22,23,24)(H,25,26,27)(H2,13,14,16,17)/b15-10-