3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-3-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-3-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-piperidyl]-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-piperidinyl]-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-3-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-piperidyl]-1-[4-(2-pyridyl)piperazino]propan-1-one Formula: C26H34N4O3 MolecularWeight: 450.57316

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC3=C(C=C2)OCCO3)CCC(=O)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

C1CC(CN(C1)CC2=CC3=C(C=C2)OCCO3)CCC(=O)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C26H34N4O3/c31-26(30-14-12-29(13-15-30)25-5-1-2-10-27-25)9-7-21-4-3-11-28(19-21)20-22-6-8-23-24(18-22)33-17-16-32-23/h1-2,5-6,8,10,18,21H,3-4,7,9,11-17,19-20H2