1-(4-methoxyphenyl)-2-[2-(3-oxidanylpropylamino)-1H-benzimidazol-4-yl]ethanone hydrobromide

Systemtic Name: 1-(4-methoxyphenyl)-2-[2-(3-oxidanylpropylamino)-1H-benzimidazol-4-yl]ethanone hydrobromide Openeye Name: 2-[2-(3-hydroxypropylamino)-1H-benzimidazol-4-yl]-1-(4-methoxyphenyl)ethanone hydrobromide CAS Name: 2-[2-(3-hydroxypropylamino)-1H-benzimidazol-4-yl]-1-(4-methoxyphenyl)ethanone hydrobromide IUPAC Name: 2-[2-(3-hydroxypropylamino)-1H-benzimidazol-4-yl]-1-(4-methoxyphenyl)ethanone hydrobromide Traditional Name: 2-[2-(3-hydroxypropylamino)-1H-benzimidazol-4-yl]-1-(4-methoxyphenyl)ethanone hydrobromide Formula: C19H22BrN3O3 MolecularWeight: 420.30028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CC2=C3C(=CC=C2)NC(=N3)NCCCO.Br

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CC2=C3C(=CC=C2)NC(=N3)NCCCO.Br

InChI

InChI=1S/C19H21N3O3.BrH/c1-25-15-8-6-13(7-9-15)17(24)12-14-4-2-5-16-18(14)22-19(21-16)20-10-3-11-23;/h2,4-9,23H,3,10-12H2,1H3,(H2,20,21,22);1H