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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=C4C(=CC=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=C4C(=CC=C3)OCO4)OC

InChI

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