(Z)-[3-(3-carboxy-4-diazonio-phenyl)-6-diazo-cyclohexa-2,4-dien-1-ylidene]-oxidanyl-methanolate

Systemtic Name: (Z)-[3-(3-carboxy-4-diazonio-phenyl)-6-diazo-cyclohexa-2,4-dien-1-ylidene]-oxidanyl-methanolate Openeye Name: (Z)-[3-(3-carboxy-4-diazonio-phenyl)-6-diazo-cyclohexa-2,4-dien-1-ylidene]-hydroxy-methanolate CAS Name: (Z)-[3-(3-carboxy-4-diazoniophenyl)-6-diazo-1-cyclohexa-2,4-dienylidene]-hydroxymethanolate IUPAC Name: (Z)-[3-(3-carboxy-4-diazoniophenyl)-6-diazocyclohexa-2,4-dien-1-ylidene]-hydroxymethanolate Traditional Name: (Z)-[3-(3-carboxy-4-diazonio-phenyl)-6-diazo-cyclohexa-2,4-dien-1-ylidene]-hydroxy-methanolate Formula: C14H8N4O4 MolecularWeight: 296.23772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=CC(=C(O)[O-])C(=[N+]=[N-])C=C2)C(=O)O)[N+]#N

Isomeric SMILES

C1=CC(=C(C=C1C2=C/C(=C(/O)\[O-])/C(=[N+]=[N-])C=C2)C(=O)O)[N+]#N

InChI

InChI=1S/C14H8N4O4/c15-17-11-3-1-7(5-9(11)13(19)20)8-2-4-12(18-16)10(6-8)14(21)22/h1-6H,(H2-,19,20,21,22)