4-bromanyl-2-nitro-6-[(1,2,4-triazol-4-ylamino)methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-bromanyl-2-nitro-6-[(1,2,4-triazol-4-ylamino)methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-2-nitro-6-[(1,2,4-triazol-4-ylamino)methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-2-nitro-6-[(1,2,4-triazol-4-ylamino)methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-2-nitro-6-[(1,2,4-triazol-4-ylamino)methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-2-nitro-6-[(1,2,4-triazol-4-ylamino)methylene]cyclohexa-2,4-dien-1-one Formula: C9H6BrN5O3 MolecularWeight: 312.07964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=O)C1=CNN2C=NN=C2)[N+](=O)[O-])Br

Isomeric SMILES

C1=C(C=C(C(=O)C1=CNN2C=NN=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C9H6BrN5O3/c10-7-1-6(3-13-14-4-11-12-5-14)9(16)8(2-7)15(17)18/h1-5,13H