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

Systemtic Name: 8-methyl-N-[[3-oxidanyl-1-(4-oxidanylbutyl)piperidin-4-yl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide Openeye Name: N-[[3-hydroxy-1-(4-hydroxybutyl)-4-piperidyl]methyl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide CAS Name: N-[[3-hydroxy-1-(4-hydroxybutyl)-4-piperidinyl]methyl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxamide IUPAC Name: N-[[3-hydroxy-1-(4-hydroxybutyl)piperidin-4-yl]methyl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide Traditional Name: N-[[3-hydroxy-1-(4-hydroxybutyl)-4-piperidyl]methyl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxamide Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N2O5/c1-15-11-17(20-19(12-15)27-9-4-10-28-20)21(26)22-13-16-5-7-23(14-18(16)25)6-2-3-8-24/h11-12,16,18,24-25H,2-10,13-14H2,1H3,(H,22,26)