1-[2-azanylidene-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-3-(3-methylphenoxy)propan-2-ol chloride

Systemtic Name: 1-[2-azanylidene-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-3-(3-methylphenoxy)propan-2-ol chloride Openeye Name: 1-[2-imino-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-3-(3-methylphenoxy)propan-2-ol chloride CAS Name: 1-[2-imino-3-[2-(1-piperidin-1-iumyl)ethyl]-1-benzimidazolyl]-3-(3-methylphenoxy)-2-propanol chloride IUPAC Name: 1-[2-imino-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-3-(3-methylphenoxy)propan-2-ol chloride Traditional Name: 1-[2-imino-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-3-(3-methylphenoxy)propan-2-ol chloride Formula: C24H33ClN4O2 MolecularWeight: 444.99742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(CN2C3=CC=CC=C3N(C2=N)CC[NH+]4CCCCC4)O.[Cl-]

Isomeric SMILES

CC1=CC(=CC=C1)OCC(CN2C3=CC=CC=C3N(C2=N)CC[NH+]4CCCCC4)O.[Cl-]

InChI

InChI=1S/C24H32N4O2.ClH/c1-19-8-7-9-21(16-19)30-18-20(29)17-28-23-11-4-3-10-22(23)27(24(28)25)15-14-26-12-5-2-6-13-26;/h3-4,7-11,16,20,25,29H,2,5-6,12-15,17-18H2,1H3;1H