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

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[methyl(piperonyl)amino]-1-(4-phenylpiperazino)ethanone Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O3/c1-22(14-17-7-8-19-20(13-17)27-16-26-19)15-21(25)24-11-9-23(10-12-24)18-5-3-2-4-6-18/h2-8,13H,9-12,14-16H2,1H3