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

Systemtic Name: [3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]piperidin-1-yl]-(5-methylpyrazin-2-yl)methanone Openeye Name: [3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-piperidyl]-(5-methylpyrazin-2-yl)methanone CAS Name: [3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-piperidinyl]-(5-methyl-2-pyrazinyl)methanone IUPAC Name: [3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]piperidin-1-yl]-(5-methylpyrazin-2-yl)methanone Traditional Name: (5-methylpyrazin-2-yl)-[3-(4-piperonylpiperazino)piperidino]methanone Formula: C23H29N5O3 MolecularWeight: 423.50806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N2CCCC(C2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N2CCCC(C2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H29N5O3/c1-17-12-25-20(13-24-17)23(29)28-6-2-3-19(15-28)27-9-7-26(8-10-27)14-18-4-5-21-22(11-18)31-16-30-21/h4-5,11-13,19H,2-3,6-10,14-16H2,1H3