1-[1,3-benzodioxol-5-yl-(3,5-dimethoxy-4-phenylmethoxy-phenyl)methyl]piperazine

Systemtic Name: 1-[1,3-benzodioxol-5-yl-(3,5-dimethoxy-4-phenylmethoxy-phenyl)methyl]piperazine Openeye Name: 1-[1,3-benzodioxol-5-yl-(4-benzyloxy-3,5-dimethoxy-phenyl)methyl]piperazine CAS Name: 1-[1,3-benzodioxol-5-yl-(3,5-dimethoxy-4-phenylmethoxyphenyl)methyl]piperazine IUPAC Name: 1-[1,3-benzodioxol-5-yl-(3,5-dimethoxy-4-phenylmethoxyphenyl)methyl]piperazine Traditional Name: 1-[1,3-benzodioxol-5-yl-(4-benzoxy-3,5-dimethoxy-phenyl)methyl]piperazine Formula: C27H30N2O5 MolecularWeight: 462.5375

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(C3=CC4=C(C=C3)OCO4)N5CCNCC5

Isomeric SMILES

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(C3=CC4=C(C=C3)OCO4)N5CCNCC5

InChI

InChI=1S/C27H30N2O5/c1-30-24-15-21(16-25(31-2)27(24)32-17-19-6-4-3-5-7-19)26(29-12-10-28-11-13-29)20-8-9-22-23(14-20)34-18-33-22/h3-9,14-16,26,28H,10-13,17-18H2,1-2H3