[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3,5-dimethoxyphenyl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3,5-dimethoxyphenyl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3,5-dimethoxyphenyl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(3,5-dimethoxyphenyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3,5-dimethoxyphenyl)methanone Traditional Name: (3,5-dimethoxyphenyl)-(4-piperonylpiperazino)methanone Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C21H24N2O5/c1-25-17-10-16(11-18(12-17)26-2)21(24)23-7-5-22(6-8-23)13-15-3-4-19-20(9-15)28-14-27-19/h3-4,9-12H,5-8,13-14H2,1-2H3