7-methoxy-2-(methoxymethyl)-1-(phenylmethyl)-4-(2-pyridin-4-ylethyl)benzimidazole dihydrate hydrochloride

Systemtic Name: 7-methoxy-2-(methoxymethyl)-1-(phenylmethyl)-4-(2-pyridin-4-ylethyl)benzimidazole dihydrate hydrochloride Openeye Name: 1-benzyl-7-methoxy-2-(methoxymethyl)-4-[2-(4-pyridyl)ethyl]benzimidazole dihydrate hydrochloride CAS Name: 7-methoxy-2-(methoxymethyl)-1-(phenylmethyl)-4-(2-pyridin-4-ylethyl)benzimidazole dihydrate hydrochloride IUPAC Name: 1-benzyl-7-methoxy-2-(methoxymethyl)-4-(2-pyridin-4-ylethyl)benzimidazole dihydrate hydrochloride Traditional Name: 1-benzyl-7-methoxy-2-(methoxymethyl)-4-[2-(4-pyridyl)ethyl]benzimidazole dihydrate hydrochloride Formula: C24H30ClN3O4 MolecularWeight: 459.9657

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NC2=C(C=CC(=C2N1CC3=CC=CC=C3)OC)CCC4=CC=NC=C4.O.O.Cl

Isomeric SMILES

COCC1=NC2=C(C=CC(=C2N1CC3=CC=CC=C3)OC)CCC4=CC=NC=C4.O.O.Cl

InChI

InChI=1S/C24H25N3O2.ClH.2H2O/c1-28-17-22-26-23-20(9-8-18-12-14-25-15-13-18)10-11-21(29-2)24(23)27(22)16-19-6-4-3-5-7-19;;;/h3-7,10-15H,8-9,16-17H2,1-2H3;1H;2*1H2