1-[1,3-benzodioxol-5-yl-(2,4,5-trimethoxyphenyl)methyl]piperazine

Systemtic Name: 1-[1,3-benzodioxol-5-yl-(2,4,5-trimethoxyphenyl)methyl]piperazine Openeye Name: 1-[1,3-benzodioxol-5-yl-(2,4,5-trimethoxyphenyl)methyl]piperazine CAS Name: 1-[1,3-benzodioxol-5-yl-(2,4,5-trimethoxyphenyl)methyl]piperazine IUPAC Name: 1-[1,3-benzodioxol-5-yl-(2,4,5-trimethoxyphenyl)methyl]piperazine Traditional Name: 1-[asaryl(1,3-benzodioxol-5-yl)methyl]piperazine Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(C2=CC3=C(C=C2)OCO3)N4CCNCC4)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(C2=CC3=C(C=C2)OCO3)N4CCNCC4)OC)OC

InChI

InChI=1S/C21H26N2O5/c1-24-17-12-19(26-3)18(25-2)11-15(17)21(23-8-6-22-7-9-23)14-4-5-16-20(10-14)28-13-27-16/h4-5,10-12,21-22H,6-9,13H2,1-3H3