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

Systemtic Name: 5-[[2-methoxy-4-[(prop-2-enylamino)methyl]phenoxy]methyl]-1,3-dimethyl-benzimidazol-2-one hydrochloride Openeye Name: 5-[[4-[(allylamino)methyl]-2-methoxy-phenoxy]methyl]-1,3-dimethyl-benzimidazol-2-one hydrochloride CAS Name: 5-[[2-methoxy-4-[(prop-2-enylamino)methyl]phenoxy]methyl]-1,3-dimethyl-2-benzimidazolone hydrochloride IUPAC Name: 5-[[2-methoxy-4-[(prop-2-enylamino)methyl]phenoxy]methyl]-1,3-dimethylbenzimidazol-2-one hydrochloride Traditional Name: 5-[[4-[(allylamino)methyl]-2-methoxy-phenoxy]methyl]-1,3-dimethyl-benzimidazol-2-one hydrochloride Formula: C21H26ClN3O3 MolecularWeight: 403.90244

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)COC3=C(C=C(C=C3)CNCC=C)OC)N(C1=O)C.Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2)COC3=C(C=C(C=C3)CNCC=C)OC)N(C1=O)C.Cl

InChI

InChI=1S/C21H25N3O3.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;/h5-9,11-12,22H,1,10,13-14H2,2-4H3;1H