1-[2-azanylidene-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-3,3-dimethyl-butan-2-ol chloride

Systemtic Name: 1-[2-azanylidene-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-3,3-dimethyl-butan-2-ol chloride Openeye Name: 1-[2-imino-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-3,3-dimethyl-butan-2-ol chloride CAS Name: 1-[2-imino-3-[2-(1-piperidin-1-iumyl)ethyl]-1-benzimidazolyl]-3,3-dimethyl-2-butanol chloride IUPAC Name: 1-[2-imino-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-3,3-dimethylbutan-2-ol chloride Traditional Name: 1-[2-imino-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-3,3-dimethyl-butan-2-ol chloride Formula: C20H33ClN4O MolecularWeight: 380.95522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1C2=CC=CC=C2N(C1=N)CC[NH+]3CCCCC3)O.[Cl-]

Isomeric SMILES

CC(C)(C)C(CN1C2=CC=CC=C2N(C1=N)CC[NH+]3CCCCC3)O.[Cl-]

InChI

InChI=1S/C20H32N4O.ClH/c1-20(2,3)18(25)15-24-17-10-6-5-9-16(17)23(19(24)21)14-13-22-11-7-4-8-12-22;/h5-6,9-10,18,21,25H,4,7-8,11-15H2,1-3H3;1H