5-methyl-4-nitro-1-oxidanidyl-1-oxidanyl-3H-2,1,3-benzoxadiazol-1-ium

Systemtic Name: 5-methyl-4-nitro-1-oxidanidyl-1-oxidanyl-3H-2,1,3-benzoxadiazol-1-ium Openeye Name: 1-hydroxy-5-methyl-4-nitro-1-oxido-3H-2,1,3-benzoxadiazol-1-ium CAS Name: 1-hydroxy-5-methyl-4-nitro-1-oxido-3H-2,1,3-benzoxadiazol-1-ium IUPAC Name: 1-hydroxy-5-methyl-4-nitro-1-oxido-3H-2,1,3-benzoxadiazol-1-ium Traditional Name: 3-hydroxy-6-methyl-7-nitro-3-oxido-1H-benzofurazan-3-ium Formula: C7H7N3O5 MolecularWeight: 213.14758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)[N+](ON2)(O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=C(C=C1)[N+](ON2)(O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H7N3O5/c1-4-2-3-5-6(7(4)9(11)12)8-15-10(5,13)14/h2-3,8,13H,1H3