(4Z)-6-methyl-4-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)hydrazinylidene]-2-nitro-3-oxidanylidene-cyclohexa-1,5-diene-1-sulfonic acid

Systemtic Name: (4Z)-6-methyl-4-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)hydrazinylidene]-2-nitro-3-oxidanylidene-cyclohexa-1,5-diene-1-sulfonic acid Openeye Name: (4Z)-6-methyl-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)hydrazono]-2-nitro-3-oxo-cyclohexa-1,5-diene-1-sulfonic acid CAS Name: (4Z)-6-methyl-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)hydrazinylidene]-2-nitro-3-oxo-1-cyclohexa-1,5-dienesulfonic acid IUPAC Name: (4Z)-6-methyl-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)hydrazinylidene]-2-nitro-3-oxocyclohexa-1,5-diene-1-sulfonic acid Traditional Name: (4Z)-3-keto-4-[(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)hydrazono]-6-methyl-2-nitro-cyclohexa-1,5-diene-1-sulfonic acid Formula: C17H15N5O7S MolecularWeight: 433.3953

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NNC2=C(NN(C2=O)C3=CC=CC=C3)C)C(=O)C(=C1S(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C/C(=N/NC2=C(NN(C2=O)C3=CC=CC=C3)C)/C(=O)C(=C1S(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O7S/c1-9-8-12(15(23)14(22(25)26)16(9)30(27,28)29)18-19-13-10(2)20-21(17(13)24)11-6-4-3-5-7-11/h3-8,19-20H,1-2H3,(H,27,28,29)/b18-12-