1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-benzo[e][1]benzofuran-1-yl-ethanone

Systemtic Name: 1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-benzo[e][1]benzofuran-1-yl-ethanone Openeye Name: 1-[4-(azepane-1-carbonyl)-1-piperidyl]-2-benzo[e]benzofuran-1-yl-ethanone CAS Name: 1-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-2-(1-benzo[e]benzofuranyl)ethanone IUPAC Name: 1-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-benzo[e][1]benzofuran-1-ylethanone Traditional Name: 1-[4-(azepane-1-carbonyl)piperidino]-2-benzo[e]benzofuran-1-yl-ethanone Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C26H30N2O3/c29-24(17-21-18-31-23-10-9-19-7-3-4-8-22(19)25(21)23)27-15-11-20(12-16-27)26(30)28-13-5-1-2-6-14-28/h3-4,7-10,18,20H,1-2,5-6,11-17H2