bis(azanyl)methylidene-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]azanium

Systemtic Name: bis(azanyl)methylidene-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]azanium Openeye Name: [(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-(diaminomethylene)ammonium CAS Name: [(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-(diaminomethylidene)ammonium IUPAC Name: [(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-(diaminomethylidene)azanium Traditional Name: [(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]-(diaminomethylene)ammonium Formula: C9H12BrN4O2+ MolecularWeight: 288.12118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CN[NH+]=C(N)N)C=C(C1=O)Br

Isomeric SMILES

COC1=CC(=CN[NH+]=C(N)N)C=C(C1=O)Br

InChI

InChI=1S/C9H11BrN4O2/c1-16-7-3-5(2-6(10)8(7)15)4-13-14-9(11)12/h2-4,13H,1H3,(H4,11,12,14)/p+1