2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-[4-(phenylcarbonyl)piperidin-1-yl]ethanone

Systemtic Name: 2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-[4-(phenylcarbonyl)piperidin-1-yl]ethanone Openeye Name: 1-(4-benzoyl-1-piperidyl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanone CAS Name: 1-(4-benzoyl-1-piperidinyl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanone IUPAC Name: 1-(4-benzoylpiperidin-1-yl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanone Traditional Name: 1-(4-benzoylpiperidino)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanone Formula: C23H24ClNO4 MolecularWeight: 413.89396

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CC(=O)N3CCC(CC3)C(=O)C4=CC=CC=C4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CC(=O)N3CCC(CC3)C(=O)C4=CC=CC=C4)Cl)OC1

InChI

InChI=1S/C23H24ClNO4/c24-19-13-16(14-20-23(19)29-12-4-11-28-20)15-21(26)25-9-7-18(8-10-25)22(27)17-5-2-1-3-6-17/h1-3,5-6,13-14,18H,4,7-12,15H2