(4Z)-2-azanyl-4-[(2-bromanyl-4,5-dimethoxy-phenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one

Systemtic Name: (4Z)-2-azanyl-4-[(2-bromanyl-4,5-dimethoxy-phenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one Openeye Name: (4Z)-2-amino-4-[(2-bromo-4,5-dimethoxy-phenyl)methylene]-3-methyl-1H-imidazol-3-ium-5-one CAS Name: (4Z)-2-amino-4-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one IUPAC Name: (4Z)-2-amino-4-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one Traditional Name: (5Z)-2-amino-5-(2-bromo-4,5-dimethoxy-benzylidene)-1-methyl-2-imidazolin-1-ium-4-one Formula: C13H15BrN3O3+ MolecularWeight: 341.1805

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC(=O)C1=CC2=CC(=C(C=C2Br)OC)OC)N

Isomeric SMILES

C[N+]\1=C(NC(=O)/C1=C/C2=CC(=C(C=C2Br)OC)OC)N

InChI

InChI=1S/C13H14BrN3O3/c1-17-9(12(18)16-13(17)15)4-7-5-10(19-2)11(20-3)6-8(7)14/h4-6H,1-3H3,(H2,15,16,18)/p+1/b9-4-