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

Systemtic Name: (4E)-2-azanyl-4-[[4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]methylidene]-3-methyl-1H-imidazol-3-ium-5-one Openeye Name: (4E)-2-amino-4-[[4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]methylene]-3-methyl-1H-imidazol-3-ium-5-one CAS Name: (4E)-2-amino-4-[[4-[(4-bromophenyl)methoxy]-3-methoxyphenyl]methylidene]-3-methyl-1H-imidazol-3-ium-5-one IUPAC Name: (4E)-2-amino-4-[[4-[(4-bromophenyl)methoxy]-3-methoxyphenyl]methylidene]-3-methyl-1H-imidazol-3-ium-5-one Traditional Name: (5E)-2-amino-5-[4-(4-bromobenzyl)oxy-3-methoxy-benzylidene]-1-methyl-2-imidazolin-1-ium-4-one Formula: C19H19BrN3O3+ MolecularWeight: 417.27646

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC(=O)C1=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)Br)OC)N

Isomeric SMILES

C[N+]\1=C(NC(=O)/C1=C\C2=CC(=C(C=C2)OCC3=CC=C(C=C3)Br)OC)N

InChI

InChI=1S/C19H18BrN3O3/c1-23-15(18(24)22-19(23)21)9-13-5-8-16(17(10-13)25-2)26-11-12-3-6-14(20)7-4-12/h3-10H,11H2,1-2H3,(H2,21,22,24)/p+1/b15-9+