[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]piperidin-1-yl]-(2-ethyl-5-methyl-pyrazol-3-yl)methanone

Systemtic Name: [3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]piperidin-1-yl]-(2-ethyl-5-methyl-pyrazol-3-yl)methanone Openeye Name: [3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-piperidyl]-(2-ethyl-5-methyl-pyrazol-3-yl)methanone CAS Name: [3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-piperidinyl]-(2-ethyl-5-methyl-3-pyrazolyl)methanone IUPAC Name: [3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]piperidin-1-yl]-(2-ethyl-5-methylpyrazol-3-yl)methanone Traditional Name: (2-ethyl-5-methyl-pyrazol-3-yl)-[3-(4-piperonylpiperazino)piperidino]methanone Formula: C24H33N5O3 MolecularWeight: 439.55052

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C)C(=O)N2CCCC(C2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCN1C(=CC(=N1)C)C(=O)N2CCCC(C2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H33N5O3/c1-3-29-21(13-18(2)25-29)24(30)28-8-4-5-20(16-28)27-11-9-26(10-12-27)15-19-6-7-22-23(14-19)32-17-31-22/h6-7,13-14,20H,3-5,8-12,15-17H2,1-2H3