1-(azepan-1-yl)-2-[4-[[3-(ethoxymethyl)-1-benzofuran-2-yl]carbonyl]piperazin-1-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[4-[[3-(ethoxymethyl)-1-benzofuran-2-yl]carbonyl]piperazin-1-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[4-[3-(ethoxymethyl)benzofuran-2-carbonyl]piperazin-1-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[4-[[3-(ethoxymethyl)-2-benzofuranyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[4-[3-(ethoxymethyl)-1-benzofuran-2-carbonyl]piperazin-1-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[4-[3-(ethoxymethyl)benzofuran-2-carbonyl]piperazino]ethanone Formula: C24H33N3O4 MolecularWeight: 427.53652

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(OC2=CC=CC=C21)C(=O)N3CCN(CC3)CC(=O)N4CCCCCC4

Isomeric SMILES

CCOCC1=C(OC2=CC=CC=C21)C(=O)N3CCN(CC3)CC(=O)N4CCCCCC4

InChI

InChI=1S/C24H33N3O4/c1-2-30-18-20-19-9-5-6-10-21(19)31-23(20)24(29)27-15-13-25(14-16-27)17-22(28)26-11-7-3-4-8-12-26/h5-6,9-10H,2-4,7-8,11-18H2,1H3