(6E)-6-[[2-azanyl-6-(2-hydroxyethylamino)-5-isocyano-4-methyl-pyridin-3-yl]hydrazinylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[[2-azanyl-6-(2-hydroxyethylamino)-5-isocyano-4-methyl-pyridin-3-yl]hydrazinylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[[2-amino-6-(2-hydroxyethylamino)-5-isocyano-4-methyl-3-pyridyl]hydrazono]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[[2-amino-6-(2-hydroxyethylamino)-5-isocyano-4-methyl-3-pyridinyl]hydrazinylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[[2-amino-6-(2-hydroxyethylamino)-5-isocyano-4-methylpyridin-3-yl]hydrazinylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[[2-amino-6-(2-hydroxyethylamino)-5-isocyano-4-methyl-3-pyridyl]hydrazono]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C15H15N7O4 MolecularWeight: 357.3241

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1NN=C2C=C(C=CC2=O)[N+](=O)[O-])N)NCCO)[N+]#[C-]

Isomeric SMILES

CC1=C(C(=NC(=C1N/N=C/2\C=C(C=CC2=O)[N+](=O)[O-])N)NCCO)[N+]#[C-]

InChI

InChI=1S/C15H15N7O4/c1-8-12(14(16)19-15(13(8)17-2)18-5-6-23)21-20-10-7-9(22(25)26)3-4-11(10)24/h3-4,7,21,23H,5-6H2,1H3,(H3,16,18,19)/b20-10+