1-(azepan-1-yl)-2-[2-(hydroxymethyl)-5,6-dimethyl-benzimidazol-1-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[2-(hydroxymethyl)-5,6-dimethyl-benzimidazol-1-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[2-(hydroxymethyl)-5,6-dimethyl-benzimidazol-1-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[2-(hydroxymethyl)-5,6-dimethyl-1-benzimidazolyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[2-(hydroxymethyl)-5,6-dimethylbenzimidazol-1-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-(5,6-dimethyl-2-methylol-benzimidazol-1-yl)ethanone Formula: C18H25N3O2 MolecularWeight: 315.41

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)CO)CC(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)CO)CC(=O)N3CCCCCC3

InChI

InChI=1S/C18H25N3O2/c1-13-9-15-16(10-14(13)2)21(17(12-22)19-15)11-18(23)20-7-5-3-4-6-8-20/h9-10,22H,3-8,11-12H2,1-2H3