8-methyl-N-[[1-(4-morpholin-4-ylbutyl)-3-oxidanyl-piperidin-4-yl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide

Systemtic Name: 8-methyl-N-[[1-(4-morpholin-4-ylbutyl)-3-oxidanyl-piperidin-4-yl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide Openeye Name: N-[[3-hydroxy-1-(4-morpholinobutyl)-4-piperidyl]methyl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide CAS Name: N-[[3-hydroxy-1-[4-(4-morpholinyl)butyl]-4-piperidinyl]methyl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxamide IUPAC Name: N-[[3-hydroxy-1-(4-morpholin-4-ylbutyl)piperidin-4-yl]methyl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide Traditional Name: N-[[3-hydroxy-1-(4-morpholinobutyl)-4-piperidyl]methyl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxamide Formula: C25H39N3O5 MolecularWeight: 461.59426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1)C(=O)NCC3CCN(CC3O)CCCCN4CCOCC4)OCCCO2

Isomeric SMILES

CC1=CC2=C(C(=C1)C(=O)NCC3CCN(CC3O)CCCCN4CCOCC4)OCCCO2

InChI

InChI=1S/C25H39N3O5/c1-19-15-21(24-23(16-19)32-11-4-12-33-24)25(30)26-17-20-5-8-28(18-22(20)29)7-3-2-6-27-9-13-31-14-10-27/h15-16,20,22,29H,2-14,17-18H2,1H3,(H,26,30)