1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]ethanone

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]ethanone Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]ethanone CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-[(2-methoxy-5-methylphenyl)methyl-methylamino]ethanone IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(2-methoxy-5-methylphenyl)methyl-methylamino]ethanone Traditional Name: 2-[(2-methoxy-5-methyl-benzyl)-methyl-amino]-1-(4-piperonylpiperazino)ethanone Formula: C24H31N3O4 MolecularWeight: 425.52064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN(C)CC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN(C)CC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H31N3O4/c1-18-4-6-21(29-3)20(12-18)15-25(2)16-24(28)27-10-8-26(9-11-27)14-19-5-7-22-23(13-19)31-17-30-22/h4-7,12-13H,8-11,14-17H2,1-3H3