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

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-[4-(4-hydroxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone Traditional Name: 1-[4-(4-hydroxyphenyl)piperazino]-2-[methyl(piperonyl)amino]ethanone Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C21H25N3O4/c1-22(13-16-2-7-19-20(12-16)28-15-27-19)14-21(26)24-10-8-23(9-11-24)17-3-5-18(25)6-4-17/h2-7,12,25H,8-11,13-15H2,1H3