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

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-phenyl-propan-1-one CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-phenyl-1-propanone IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-phenylpropan-1-one Traditional Name: 3-phenyl-1-(4-piperonylpiperazino)propan-1-one Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C21H24N2O3/c24-21(9-7-17-4-2-1-3-5-17)23-12-10-22(11-13-23)15-18-6-8-19-20(14-18)26-16-25-19/h1-6,8,14H,7,9-13,15-16H2