1-(azepan-1-yl)-3-[2-(1-phenoxyethyl)benzimidazol-1-yl]propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-[2-(1-phenoxyethyl)benzimidazol-1-yl]propan-1-one Openeye Name: 1-(azepan-1-yl)-3-[2-(1-phenoxyethyl)benzimidazol-1-yl]propan-1-one CAS Name: 1-(1-azepanyl)-3-[2-(1-phenoxyethyl)-1-benzimidazolyl]-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-[2-(1-phenoxyethyl)benzimidazol-1-yl]propan-1-one Traditional Name: 1-(azepan-1-yl)-3-[2-(1-phenoxyethyl)benzimidazol-1-yl]propan-1-one Formula: C24H29N3O2 MolecularWeight: 391.50596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1CCC(=O)N3CCCCCC3)OC4=CC=CC=C4

Isomeric SMILES

CC(C1=NC2=CC=CC=C2N1CCC(=O)N3CCCCCC3)OC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O2/c1-19(29-20-11-5-4-6-12-20)24-25-21-13-7-8-14-22(21)27(24)18-15-23(28)26-16-9-2-3-10-17-26/h4-8,11-14,19H,2-3,9-10,15-18H2,1H3