1-[(3S)-3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]piperidin-1-yl]-2-piperidin-1-yl-ethanone

Systemtic Name: 1-[(3S)-3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]piperidin-1-yl]-2-piperidin-1-yl-ethanone Openeye Name: 1-[(3S)-3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-piperidyl]-2-(1-piperidyl)ethanone CAS Name: 1-[(3S)-3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-piperidinyl]-2-(1-piperidinyl)ethanone IUPAC Name: 1-[(3S)-3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]piperidin-1-yl]-2-piperidin-1-ylethanone Traditional Name: 2-piperidino-1-[(3S)-3-(4-piperonylpiperazino)piperidino]ethanone Formula: C24H36N4O3 MolecularWeight: 428.56764

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(=O)N2CCCC(C2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCN(CC1)CC(=O)N2CCC[C@@H](C2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H36N4O3/c29-24(18-25-8-2-1-3-9-25)28-10-4-5-21(17-28)27-13-11-26(12-14-27)16-20-6-7-22-23(15-20)31-19-30-22/h6-7,15,21H,1-5,8-14,16-19H2/t21-/m0/s1