6,7-dimethoxy-2-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-2-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 6,7-dimethoxy-2-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethoxy-2-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethoxy-2-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 6,7-dimethoxy-2-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-3,4-dihydro-1H-isoquinoline Formula: C19H20N2O6 MolecularWeight: 372.3719

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CC3=CC4=C(C=C3[N+](=O)[O-])OCO4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CC3=CC4=C(C=C3[N+](=O)[O-])OCO4)OC

InChI

InChI=1S/C19H20N2O6/c1-24-16-5-12-3-4-20(9-13(12)6-17(16)25-2)10-14-7-18-19(27-11-26-18)8-15(14)21(22)23/h5-8H,3-4,9-11H2,1-2H3