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

Systemtic Name: 8-chloranyl-N-[[3-oxidanyl-1-(3-oxidanylpropyl)piperidin-4-yl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide Openeye Name: 8-chloro-N-[[3-hydroxy-1-(3-hydroxypropyl)-4-piperidyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide CAS Name: 8-chloro-N-[[3-hydroxy-1-(3-hydroxypropyl)-4-piperidinyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxamide IUPAC Name: 8-chloro-N-[[3-hydroxy-1-(3-hydroxypropyl)piperidin-4-yl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide Traditional Name: 8-chloro-N-[[3-hydroxy-1-(3-hydroxypropyl)-4-piperidyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxamide Formula: C19H27ClN2O5 MolecularWeight: 398.88108

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)Cl)C(=O)NCC3CCN(CC3O)CCCO)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)Cl)C(=O)NCC3CCN(CC3O)CCCO)OC1

InChI

InChI=1S/C19H27ClN2O5/c20-14-9-15(18-17(10-14)26-7-2-8-27-18)19(25)21-11-13-3-5-22(4-1-6-23)12-16(13)24/h9-10,13,16,23-24H,1-8,11-12H2,(H,21,25)