2-(2-azanyl-3-prop-2-enyl-benzimidazol-1-ium-1-yl)-1-(furan-2-yl)ethanone bromide

Systemtic Name: 2-(2-azanyl-3-prop-2-enyl-benzimidazol-1-ium-1-yl)-1-(furan-2-yl)ethanone bromide Openeye Name: 2-(3-allyl-2-amino-benzimidazol-1-ium-1-yl)-1-(2-furyl)ethanone bromide CAS Name: 2-(2-amino-3-prop-2-enyl-1-benzimidazol-1-iumyl)-1-(2-furanyl)ethanone bromide IUPAC Name: 2-(2-amino-3-prop-2-enylbenzimidazol-1-ium-1-yl)-1-(furan-2-yl)ethanone bromide Traditional Name: 2-(3-allyl-2-amino-benzimidazol-1-ium-1-yl)-1-(2-furyl)ethanone bromide Formula: C16H16BrN3O2 MolecularWeight: 362.22114

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C3=CC=CO3.[Br-]

Isomeric SMILES

C=CCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C3=CC=CO3.[Br-]

InChI

InChI=1S/C16H15N3O2.BrH/c1-2-9-18-12-6-3-4-7-13(12)19(16(18)17)11-14(20)15-8-5-10-21-15;/h2-8,10,17H,1,9,11H2;1H