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

Systemtic Name: 1-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]piperidin-1-yl]-2-(cyclohexen-1-yl)ethanone Openeye Name: 1-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-piperidyl]-2-(cyclohexen-1-yl)ethanone CAS Name: 1-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-piperidinyl]-2-(1-cyclohexenyl)ethanone IUPAC Name: 1-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]piperidin-1-yl]-2-(cyclohexen-1-yl)ethanone Traditional Name: 2-(cyclohexen-1-yl)-1-[3-(4-piperonylpiperazino)piperidino]ethanone Formula: C25H35N3O3 MolecularWeight: 425.5637

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CC(=O)N2CCCC(C2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCC(=CC1)CC(=O)N2CCCC(C2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H35N3O3/c29-25(16-20-5-2-1-3-6-20)28-10-4-7-22(18-28)27-13-11-26(12-14-27)17-21-8-9-23-24(15-21)31-19-30-23/h5,8-9,15,22H,1-4,6-7,10-14,16-19H2