3-[[3,5-bis(azanyl)-1-phenyl-pyrazol-4-yl]hydrazinylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylic acid

Systemtic Name: 3-[[3,5-bis(azanyl)-1-phenyl-pyrazol-4-yl]hydrazinylidene]-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxylic acid Openeye Name: 3-[(3,5-diamino-1-phenyl-pyrazol-4-yl)hydrazono]-6-oxo-cyclohexa-1,4-diene-1-carboxylic acid CAS Name: 3-[(3,5-diamino-1-phenyl-4-pyrazolyl)hydrazinylidene]-6-oxo-1-cyclohexa-1,4-dienecarboxylic acid IUPAC Name: 3-[(3,5-diamino-1-phenylpyrazol-4-yl)hydrazinylidene]-6-oxocyclohexa-1,4-diene-1-carboxylic acid Traditional Name: 3-[(3,5-diamino-1-phenyl-pyrazol-4-yl)hydrazono]-6-keto-cyclohexa-1,4-diene-1-carboxylic acid Formula: C16H14N6O3 MolecularWeight: 338.32076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=N2)N)NN=C3C=CC(=O)C(=C3)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=N2)N)NN=C3C=CC(=O)C(=C3)C(=O)O)N

InChI

InChI=1S/C16H14N6O3/c17-14-13(15(18)22(21-14)10-4-2-1-3-5-10)20-19-9-6-7-12(23)11(8-9)16(24)25/h1-8,20H,18H2,(H2,17,21)(H,24,25)