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

Systemtic Name: 8-methyl-N-[[(3R,4R)-3-oxidanylpiperidin-4-yl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide Openeye Name: N-[[(3R,4R)-3-hydroxy-4-piperidyl]methyl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide CAS Name: N-[[(3R,4R)-3-hydroxy-4-piperidinyl]methyl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxamide IUPAC Name: N-[[(3R,4R)-3-hydroxypiperidin-4-yl]methyl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxamide Traditional Name: N-[[(3R,4R)-3-hydroxy-4-piperidyl]methyl]-8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-6-carboxamide Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1)C(=O)NCC3CCNCC3O)OCCCO2

Isomeric SMILES

CC1=CC2=C(C(=C1)C(=O)NC[C@H]3CCNC[C@@H]3O)OCCCO2

InChI

InChI=1S/C17H24N2O4/c1-11-7-13(16-15(8-11)22-5-2-6-23-16)17(21)19-9-12-3-4-18-10-14(12)20/h7-8,12,14,18,20H,2-6,9-10H2,1H3,(H,19,21)/t12-,14+/m1/s1