2-[2-azanylidene-3-[3-(4-methylphenoxy)-2-oxidanyl-propyl]benzimidazol-1-yl]ethyl-diethyl-azanium chloride

Systemtic Name: 2-[2-azanylidene-3-[3-(4-methylphenoxy)-2-oxidanyl-propyl]benzimidazol-1-yl]ethyl-diethyl-azanium chloride Openeye Name: diethyl-[2-[3-[2-hydroxy-3-(4-methylphenoxy)propyl]-2-imino-benzimidazol-1-yl]ethyl]ammonium chloride CAS Name: diethyl-[2-[3-[2-hydroxy-3-(4-methylphenoxy)propyl]-2-imino-1-benzimidazolyl]ethyl]ammonium chloride IUPAC Name: diethyl-[2-[3-[2-hydroxy-3-(4-methylphenoxy)propyl]-2-iminobenzimidazol-1-yl]ethyl]azanium chloride Traditional Name: diethyl-[2-[3-[2-hydroxy-3-(4-methylphenoxy)propyl]-2-imino-benzimidazol-1-yl]ethyl]ammonium chloride Formula: C23H33ClN4O2 MolecularWeight: 432.98672

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=CC=CC=C2N(C1=N)CC(COC3=CC=C(C=C3)C)O.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCN1C2=CC=CC=C2N(C1=N)CC(COC3=CC=C(C=C3)C)O.[Cl-]

InChI

InChI=1S/C23H32N4O2.ClH/c1-4-25(5-2)14-15-26-21-8-6-7-9-22(21)27(23(26)24)16-19(28)17-29-20-12-10-18(3)11-13-20;/h6-13,19,24,28H,4-5,14-17H2,1-3H3;1H