1-[2-azanyl-3-(2-dimethylaminoethyl)benzimidazol-1-ium-1-yl]-3,3-dimethyl-butan-2-one

Systemtic Name: 1-[2-azanyl-3-(2-dimethylaminoethyl)benzimidazol-1-ium-1-yl]-3,3-dimethyl-butan-2-one Openeye Name: 1-[2-amino-3-(2-dimethylaminoethyl)benzimidazol-1-ium-1-yl]-3,3-dimethyl-butan-2-one CAS Name: 1-[2-amino-3-(2-dimethylaminoethyl)-1-benzimidazol-1-iumyl]-3,3-dimethyl-2-butanone IUPAC Name: 1-[2-amino-3-(2-dimethylaminoethyl)benzimidazol-1-ium-1-yl]-3,3-dimethylbutan-2-one Traditional Name: 1-[2-amino-3-(2-dimethylaminoethyl)benzimidazol-1-ium-1-yl]-3,3-dimethyl-butan-2-one Formula: C17H27N4O+ MolecularWeight: 303.42248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C[N+]1=C(N(C2=CC=CC=C21)CCN(C)C)N

Isomeric SMILES

CC(C)(C)C(=O)C[N+]1=C(N(C2=CC=CC=C21)CCN(C)C)N

InChI

InChI=1S/C17H26N4O/c1-17(2,3)15(22)12-21-14-9-7-6-8-13(14)20(16(21)18)11-10-19(4)5/h6-9,18H,10-12H2,1-5H3/p+1