6-(7,8-dimethoxy-2-methyl-1-oxidanylidene-isoquinolin-3-yl)-1,3-benzodioxole-5-carbaldehyde

Systemtic Name: 6-(7,8-dimethoxy-2-methyl-1-oxidanylidene-isoquinolin-3-yl)-1,3-benzodioxole-5-carbaldehyde Openeye Name: 6-(7,8-dimethoxy-2-methyl-1-oxo-3-isoquinolyl)-1,3-benzodioxole-5-carbaldehyde CAS Name: 6-(7,8-dimethoxy-2-methyl-1-oxo-3-isoquinolinyl)-1,3-benzodioxole-5-carboxaldehyde IUPAC Name: 6-(7,8-dimethoxy-2-methyl-1-oxoisoquinolin-3-yl)-1,3-benzodioxole-5-carbaldehyde Traditional Name: 6-(1-keto-7,8-dimethoxy-2-methyl-3-isoquinolyl)piperonal Formula: C20H17NO6 MolecularWeight: 367.35208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C(C1=O)C(=C(C=C2)OC)OC)C3=CC4=C(C=C3C=O)OCO4

Isomeric SMILES

CN1C(=CC2=C(C1=O)C(=C(C=C2)OC)OC)C3=CC4=C(C=C3C=O)OCO4

InChI

InChI=1S/C20H17NO6/c1-21-14(13-8-17-16(26-10-27-17)7-12(13)9-22)6-11-4-5-15(24-2)19(25-3)18(11)20(21)23/h4-9H,10H2,1-3H3