5-[[2-methoxy-4-(propylaminomethyl)phenoxy]methyl]-1,3-dimethyl-benzimidazol-2-one hydrochloride

Systemtic Name: 5-[[2-methoxy-4-(propylaminomethyl)phenoxy]methyl]-1,3-dimethyl-benzimidazol-2-one hydrochloride Openeye Name: 5-[[2-methoxy-4-(propylaminomethyl)phenoxy]methyl]-1,3-dimethyl-benzimidazol-2-one hydrochloride CAS Name: 5-[[2-methoxy-4-(propylaminomethyl)phenoxy]methyl]-1,3-dimethyl-2-benzimidazolone hydrochloride IUPAC Name: 5-[[2-methoxy-4-(propylaminomethyl)phenoxy]methyl]-1,3-dimethylbenzimidazol-2-one hydrochloride Traditional Name: 5-[[2-methoxy-4-(propylaminomethyl)phenoxy]methyl]-1,3-dimethyl-benzimidazol-2-one hydrochloride Formula: C21H28ClN3O3 MolecularWeight: 405.91832

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=CC(=C(C=C1)OCC2=CC3=C(C=C2)N(C(=O)N3C)C)OC.Cl

Isomeric SMILES

CCCNCC1=CC(=C(C=C1)OCC2=CC3=C(C=C2)N(C(=O)N3C)C)OC.Cl

InChI

InChI=1S/C21H27N3O3.ClH/c1-5-10-22-13-15-7-9-19(20(12-15)26-4)27-14-16-6-8-17-18(11-16)24(3)21(25)23(17)2;/h6-9,11-12,22H,5,10,13-14H2,1-4H3;1H