1-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-(6,7-dimethyl-1-benzofuran-3-yl)ethanone

Systemtic Name: 1-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-(6,7-dimethyl-1-benzofuran-3-yl)ethanone Openeye Name: 1-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-1-yl]-2-(6,7-dimethylbenzofuran-3-yl)ethanone CAS Name: 1-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazinyl]-2-(6,7-dimethyl-3-benzofuranyl)ethanone IUPAC Name: 1-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(6,7-dimethyl-1-benzofuran-3-yl)ethanone Traditional Name: 1-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazino]-2-(6,7-dimethylbenzofuran-3-yl)ethanone Formula: C24H33N3O3 MolecularWeight: 411.53712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)CC(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)CC(=O)N4CCCCCC4)C

InChI

InChI=1S/C24H33N3O3/c1-18-7-8-21-20(17-30-24(21)19(18)2)15-22(28)27-13-11-25(12-14-27)16-23(29)26-9-5-3-4-6-10-26/h7-8,17H,3-6,9-16H2,1-2H3