1-(2-azanylidene-3-prop-2-enyl-benzimidazol-1-yl)-3-(3-methylphenoxy)propan-2-ol hydrochloride

Systemtic Name: 1-(2-azanylidene-3-prop-2-enyl-benzimidazol-1-yl)-3-(3-methylphenoxy)propan-2-ol hydrochloride Openeye Name: 1-(3-allyl-2-imino-benzimidazol-1-yl)-3-(3-methylphenoxy)propan-2-ol hydrochloride CAS Name: 1-(2-imino-3-prop-2-enyl-1-benzimidazolyl)-3-(3-methylphenoxy)-2-propanol hydrochloride IUPAC Name: 1-(2-imino-3-prop-2-enylbenzimidazol-1-yl)-3-(3-methylphenoxy)propan-2-ol hydrochloride Traditional Name: 1-(3-allyl-2-imino-benzimidazol-1-yl)-3-(3-methylphenoxy)propan-2-ol hydrochloride Formula: C20H24ClN3O2 MolecularWeight: 373.87646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(CN2C3=CC=CC=C3N(C2=N)CC=C)O.Cl

Isomeric SMILES

CC1=CC(=CC=C1)OCC(CN2C3=CC=CC=C3N(C2=N)CC=C)O.Cl

InChI

InChI=1S/C20H23N3O2.ClH/c1-3-11-22-18-9-4-5-10-19(18)23(20(22)21)13-16(24)14-25-17-8-6-7-15(2)12-17;/h3-10,12,16,21,24H,1,11,13-14H2,2H3;1H