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

Systemtic Name: 1-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]piperidin-1-yl]-2-(3-methylpyrazol-1-yl)ethanone Openeye Name: 1-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-piperidyl]-2-(3-methylpyrazol-1-yl)ethanone CAS Name: 1-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-piperidinyl]-2-(3-methyl-1-pyrazolyl)ethanone IUPAC Name: 1-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]piperidin-1-yl]-2-(3-methylpyrazol-1-yl)ethanone Traditional Name: 2-(3-methylpyrazol-1-yl)-1-[3-(4-piperonylpiperazino)piperidino]ethanone Formula: C23H31N5O3 MolecularWeight: 425.52394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)CC(=O)N2CCCC(C2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=NN(C=C1)CC(=O)N2CCCC(C2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H31N5O3/c1-18-6-8-28(24-18)16-23(29)27-7-2-3-20(15-27)26-11-9-25(10-12-26)14-19-4-5-21-22(13-19)31-17-30-21/h4-6,8,13,20H,2-3,7,9-12,14-17H2,1H3