1-(1,3-benzodioxol-5-ylmethyl)-4-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(6,7-dimethoxyisochroman-1-yl)methyl]piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(6,7-dimethoxy-3,4-dihydro-1H-2-benzopyran-1-yl)methyl]piperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]piperazine Traditional Name: 1-[(6,7-dimethoxyisochroman-1-yl)methyl]-4-piperonyl-piperazine Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(OCCC2=C1)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

COC1=C(C=C2C(OCCC2=C1)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C24H30N2O5/c1-27-21-12-18-5-10-29-24(19(18)13-22(21)28-2)15-26-8-6-25(7-9-26)14-17-3-4-20-23(11-17)31-16-30-20/h3-4,11-13,24H,5-10,14-16H2,1-2H3