4-(3-bromophenyl)-3-methyl-N-[(5-methylfuran-2-yl)methyl]-1H-imidazol-3-ium-2-amine

Systemtic Name: 4-(3-bromophenyl)-3-methyl-N-[(5-methylfuran-2-yl)methyl]-1H-imidazol-3-ium-2-amine Openeye Name: 4-(3-bromophenyl)-3-methyl-N-[(5-methyl-2-furyl)methyl]-1H-imidazol-3-ium-2-amine CAS Name: 4-(3-bromophenyl)-3-methyl-N-[(5-methyl-2-furanyl)methyl]-1H-imidazol-3-ium-2-amine IUPAC Name: 4-(3-bromophenyl)-3-methyl-N-[(5-methylfuran-2-yl)methyl]-1H-imidazol-3-ium-2-amine Traditional Name: [4-(3-bromophenyl)-3-methyl-1H-imidazol-3-ium-2-yl]-[(5-methyl-2-furyl)methyl]amine Formula: C16H17BrN3O+ MolecularWeight: 347.22968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC2=[N+](C(=CN2)C3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1=CC=C(O1)CNC2=[N+](C(=CN2)C3=CC(=CC=C3)Br)C

InChI

InChI=1S/C16H16BrN3O/c1-11-6-7-14(21-11)9-18-16-19-10-15(20(16)2)12-4-3-5-13(17)8-12/h3-8,10H,9H2,1-2H3,(H,18,19)/p+1