3-azanyl-4-azanylidene-5-nitro-cyclohexa-2,5-dien-1-one

Systemtic Name: 3-azanyl-4-azanylidene-5-nitro-cyclohexa-2,5-dien-1-one Openeye Name: 3-amino-4-imino-5-nitro-cyclohexa-2,5-dien-1-one CAS Name: 3-amino-4-imino-5-nitro-1-cyclohexa-2,5-dienone IUPAC Name: 3-amino-4-imino-5-nitrocyclohexa-2,5-dien-1-one Traditional Name: 3-amino-4-imino-5-nitro-cyclohexa-2,5-dien-1-one Formula: C6H5N3O3 MolecularWeight: 167.1222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H5N3O3/c7-4-1-3(10)2-5(6(4)8)9(11)12/h1-2,8H,7H2