1-(1-adamantyl)-2-(2-azanyl-3-butyl-benzimidazol-1-ium-1-yl)ethanone

Systemtic Name: 1-(1-adamantyl)-2-(2-azanyl-3-butyl-benzimidazol-1-ium-1-yl)ethanone Openeye Name: 1-(1-adamantyl)-2-(2-amino-3-butyl-benzimidazol-1-ium-1-yl)ethanone CAS Name: 1-(1-adamantyl)-2-(2-amino-3-butyl-1-benzimidazol-1-iumyl)ethanone IUPAC Name: 1-(1-adamantyl)-2-(2-amino-3-butylbenzimidazol-1-ium-1-yl)ethanone Traditional Name: 1-(1-adamantyl)-2-(2-amino-3-butyl-benzimidazol-1-ium-1-yl)ethanone Formula: C23H32N3O+ MolecularWeight: 366.51968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H31N3O/c1-2-3-8-25-19-6-4-5-7-20(19)26(22(25)24)15-21(27)23-12-16-9-17(13-23)11-18(10-16)14-23/h4-7,16-18,24H,2-3,8-15H2,1H3/p+1