1-(azepan-1-yl)-3-[2-[(4-methoxyphenyl)methyl]benzimidazol-1-yl]propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-[2-[(4-methoxyphenyl)methyl]benzimidazol-1-yl]propan-1-one Openeye Name: 1-(azepan-1-yl)-3-[2-[(4-methoxyphenyl)methyl]benzimidazol-1-yl]propan-1-one CAS Name: 1-(1-azepanyl)-3-[2-[(4-methoxyphenyl)methyl]-1-benzimidazolyl]-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-[2-[(4-methoxyphenyl)methyl]benzimidazol-1-yl]propan-1-one Traditional Name: 1-(azepan-1-yl)-3-(2-p-anisylbenzimidazol-1-yl)propan-1-one Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NC3=CC=CC=C3N2CCC(=O)N4CCCCCC4

InChI

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