2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(4-methylpiperazin-1-yl)propan-1-one

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(4-methylpiperazin-1-yl)propan-1-one Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(4-methylpiperazin-1-yl)propan-1-one CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-(4-methyl-1-piperazinyl)-1-propanone IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(4-methylpiperazin-1-yl)propan-1-one Traditional Name: 1-(4-methylpiperazino)-2-(4-piperonylpiperazino)propan-1-one Formula: C20H30N4O3 MolecularWeight: 374.4772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H30N4O3/c1-16(20(25)24-9-5-21(2)6-10-24)23-11-7-22(8-12-23)14-17-3-4-18-19(13-17)27-15-26-18/h3-4,13,16H,5-12,14-15H2,1-2H3