5-(2,5-dimethoxyphenyl)-7,8-dimethoxy-1-(phenylmethyl)-2H-pyrazolo[3,4-c]isoquinoline

Systemtic Name: 5-(2,5-dimethoxyphenyl)-7,8-dimethoxy-1-(phenylmethyl)-2H-pyrazolo[3,4-c]isoquinoline Openeye Name: 1-benzyl-5-(2,5-dimethoxyphenyl)-7,8-dimethoxy-2H-pyrazolo[3,4-c]isoquinoline CAS Name: 5-(2,5-dimethoxyphenyl)-7,8-dimethoxy-1-(phenylmethyl)-2H-pyrazolo[3,4-c]isoquinoline IUPAC Name: 1-benzyl-5-(2,5-dimethoxyphenyl)-7,8-dimethoxy-2H-pyrazolo[3,4-c]isoquinoline Traditional Name: 1-benzyl-5-(2,5-dimethoxyphenyl)-7,8-dimethoxy-2H-pyrazol[3,4-c]isoquinoline Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=NC3=NNC(=C3C4=CC(=C(C=C42)OC)OC)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=NC3=NNC(=C3C4=CC(=C(C=C42)OC)OC)CC5=CC=CC=C5

InChI

InChI=1S/C27H25N3O4/c1-31-17-10-11-22(32-2)20(13-17)26-19-15-24(34-4)23(33-3)14-18(19)25-21(29-30-27(25)28-26)12-16-8-6-5-7-9-16/h5-11,13-15H,12H2,1-4H3,(H,28,29,30)