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

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(4-dimethylaminophenyl)propan-1-one Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(4-dimethylaminophenyl)propan-1-one CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-(4-dimethylaminophenyl)-1-propanone IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(4-dimethylaminophenyl)propan-1-one Traditional Name: 3-(4-dimethylaminophenyl)-1-(4-piperonylpiperazino)propan-1-one Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O3/c1-24(2)20-7-3-18(4-8-20)6-10-23(27)26-13-11-25(12-14-26)16-19-5-9-21-22(15-19)29-17-28-21/h3-5,7-9,15H,6,10-14,16-17H2,1-2H3