4-[[7-(dimethylamino)-4-nitro-1,3-dihydro-2,1,3-benzoxadiazol-5-yl]imino]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[7-(dimethylamino)-4-nitro-1,3-dihydro-2,1,3-benzoxadiazol-5-yl]imino]cyclohexa-2,5-dien-1-one Openeye Name: 4-[[7-(dimethylamino)-4-nitro-1,3-dihydro-2,1,3-benzoxadiazol-5-yl]imino]cyclohexa-2,5-dien-1-one CAS Name: 4-[[7-(dimethylamino)-4-nitro-1,3-dihydro-2,1,3-benzoxadiazol-5-yl]imino]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[7-(dimethylamino)-4-nitro-1,3-dihydro-2,1,3-benzoxadiazol-5-yl]imino]cyclohexa-2,5-dien-1-one Traditional Name: 4-[[7-(dimethylamino)-4-nitro-1,3-dihydrobenzofurazan-5-yl]imino]cyclohexa-2,5-dien-1-one Formula: C14H13N5O4 MolecularWeight: 315.28412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C2C(=C(C(=C1)N=C3C=CC(=O)C=C3)[N+](=O)[O-])NON2

Isomeric SMILES

CN(C)C1=C2C(=C(C(=C1)N=C3C=CC(=O)C=C3)[N+](=O)[O-])NON2

InChI

InChI=1S/C14H13N5O4/c1-18(2)11-7-10(15-8-3-5-9(20)6-4-8)14(19(21)22)13-12(11)16-23-17-13/h3-7,16-17H,1-2H3