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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(C2=CC3=C(C=C2)OCO3)N4CCNCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(C2=CC3=C(C=C2)OCO3)N4CCNCC4

InChI

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