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

Systemtic Name: 4-[(7-chloranyl-4-nitro-1,3-dihydro-2,1,3-benzoxadiazol-5-yl)imino]cyclohexa-2,5-dien-1-one Openeye Name: 4-[(7-chloro-4-nitro-1,3-dihydro-2,1,3-benzoxadiazol-5-yl)imino]cyclohexa-2,5-dien-1-one CAS Name: 4-[(7-chloro-4-nitro-1,3-dihydro-2,1,3-benzoxadiazol-5-yl)imino]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(7-chloro-4-nitro-1,3-dihydro-2,1,3-benzoxadiazol-5-yl)imino]cyclohexa-2,5-dien-1-one Traditional Name: 4-[(7-chloro-4-nitro-1,3-dihydrobenzofurazan-5-yl)imino]cyclohexa-2,5-dien-1-one Formula: C12H7ClN4O4 MolecularWeight: 306.66138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=NC2=CC(=C3C(=C2[N+](=O)[O-])NON3)Cl

Isomeric SMILES

C1=CC(=O)C=CC1=NC2=CC(=C3C(=C2[N+](=O)[O-])NON3)Cl

InChI

InChI=1S/C12H7ClN4O4/c13-8-5-9(14-6-1-3-7(18)4-2-6)12(17(19)20)11-10(8)15-21-16-11/h1-5,15-16H