(6E)-6-[(3,5-dinitro-2-oxidanyl-phenyl)hydrazinylidene]-4-methyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[(3,5-dinitro-2-oxidanyl-phenyl)hydrazinylidene]-4-methyl-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[(2-hydroxy-3,5-dinitro-phenyl)hydrazono]-4-methyl-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[(2-hydroxy-3,5-dinitrophenyl)hydrazinylidene]-4-methyl-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[(2-hydroxy-3,5-dinitrophenyl)hydrazinylidene]-4-methylcyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[(2-hydroxy-3,5-dinitro-phenyl)hydrazono]-4-methyl-cyclohexa-2,4-dien-1-one Formula: C13H10N4O6 MolecularWeight: 318.2417

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NNC2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-])C(=O)C=C1

Isomeric SMILES

CC1=C/C(=N\NC2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-])/C(=O)C=C1

InChI

InChI=1S/C13H10N4O6/c1-7-2-3-12(18)9(4-7)14-15-10-5-8(16(20)21)6-11(13(10)19)17(22)23/h2-6,15,19H,1H3/b14-9+