(3R)-3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]azepan-2-one

Systemtic Name: (3R)-3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]azepan-2-one Openeye Name: (3R)-3-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-piperidyl]azepan-2-one CAS Name: (3R)-3-[4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-1-piperidinyl]-2-azepanone IUPAC Name: (3R)-3-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidin-1-yl]azepan-2-one Traditional Name: (3R)-3-[4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)piperidino]azepan-2-one Formula: C20H26N2O4 MolecularWeight: 358.43144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N2CCC(CC2)C(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCNC(=O)[C@@H](C1)N2CCC(CC2)C(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H26N2O4/c23-19(15-4-5-17-18(13-15)26-12-11-25-17)14-6-9-22(10-7-14)16-3-1-2-8-21-20(16)24/h4-5,13-14,16H,1-3,6-12H2,(H,21,24)/t16-/m1/s1