[2-[(6-bromanyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [2-[(6-bromanyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-[(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]-2-oxoethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[(6-bromo-2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: benzyl-[2-[(6-bromo-2-keto-1,3-dihydrobenzimidazol-5-yl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C17H18BrN4O2+ MolecularWeight: 390.25442

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC(=O)NC2=C(C=C3C(=C2)NC(=O)N3)Br

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC(=O)NC2=C(C=C3C(=C2)NC(=O)N3)Br

InChI

InChI=1S/C17H17BrN4O2/c1-22(9-11-5-3-2-4-6-11)10-16(23)19-13-8-15-14(7-12(13)18)20-17(24)21-15/h2-8H,9-10H2,1H3,(H,19,23)(H2,20,21,24)/p+1