1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-2-(2-ethyl-6-methyl-pyridin-3-yl)oxy-ethanone

Systemtic Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-2-(2-ethyl-6-methyl-pyridin-3-yl)oxy-ethanone Openeye Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidyl]-2-[(2-ethyl-6-methyl-3-pyridyl)oxy]ethanone CAS Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidinyl]-2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethanone IUPAC Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-2-(2-ethyl-6-methylpyridin-3-yl)oxyethanone Traditional Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidino]-2-[(2-ethyl-6-methyl-3-pyridyl)oxy]ethanone Formula: C23H29N3O4 MolecularWeight: 411.49406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=N1)C)OCC(=O)N2CCCC(C2)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCC1=C(C=CC(=N1)C)OCC(=O)N2CCC[C@@H](C2)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H29N3O4/c1-3-19-20(8-6-16(2)24-19)30-15-23(27)26-10-4-5-18(14-26)25-17-7-9-21-22(13-17)29-12-11-28-21/h6-9,13,18,25H,3-5,10-12,14-15H2,1-2H3/t18-/m0/s1