[4-(4-azidophenyl)-6-diazo-cyclohexa-1,3-dien-1-yl]-sulfo-sulfamic acid

Systemtic Name: [4-(4-azidophenyl)-6-diazo-cyclohexa-1,3-dien-1-yl]-sulfo-sulfamic acid Openeye Name: [4-(4-azidophenyl)-6-diazo-cyclohexa-1,3-dien-1-yl]-sulfo-sulfamic acid CAS Name: [4-(4-azidophenyl)-6-diazo-1-cyclohexa-1,3-dienyl]-sulfosulfamic acid IUPAC Name: [4-(4-azidophenyl)-6-diazocyclohexa-1,3-dien-1-yl]-sulfosulfamic acid Traditional Name: [4-(4-azidophenyl)-6-diazo-cyclohexa-1,3-dien-1-yl]-sulfo-sulfamic acid Formula: C12H10N6O6S2 MolecularWeight: 398.3744

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC=C(C1=[N+]=[N-])N(S(=O)(=O)O)S(=O)(=O)O)C2=CC=C(C=C2)N=[N+]=[N-]

Isomeric SMILES

C1C(=CC=C(C1=[N+]=[N-])N(S(=O)(=O)O)S(=O)(=O)O)C2=CC=C(C=C2)N=[N+]=[N-]

InChI

InChI=1S/C12H10N6O6S2/c13-15-11-7-9(8-1-4-10(5-2-8)16-17-14)3-6-12(11)18(25(19,20)21)26(22,23)24/h1-6H,7H2,(H,19,20,21)(H,22,23,24)