(4E)-2-azanyl-4-[(4-bromophenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one

Systemtic Name: (4E)-2-azanyl-4-[(4-bromophenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one Openeye Name: (4E)-2-amino-4-[(4-bromophenyl)methylene]-3-methyl-1H-imidazol-3-ium-5-one CAS Name: (4E)-2-amino-4-[(4-bromophenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one IUPAC Name: (4E)-2-amino-4-[(4-bromophenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one Traditional Name: (5E)-2-amino-5-(4-bromobenzylidene)-1-methyl-2-imidazolin-1-ium-4-one Formula: C11H11BrN3O+ MolecularWeight: 281.12854

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC(=O)C1=CC2=CC=C(C=C2)Br)N

Isomeric SMILES

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

InChI

InChI=1S/C11H10BrN3O/c1-15-9(10(16)14-11(15)13)6-7-2-4-8(12)5-3-7/h2-6H,1H3,(H2,13,14,16)/p+1/b9-6+