2-[3-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-isoquinolin-4-yl]ethanol

Systemtic Name: 2-[3-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-isoquinolin-4-yl]ethanol Openeye Name: 2-[3-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-4-isoquinolyl]ethanol CAS Name: 2-[3-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-4-isoquinolinyl]ethanol IUPAC Name: 2-[3-(1,3-benzodioxol-5-yl)-6,7-dimethoxyisoquinolin-4-yl]ethanol Traditional Name: 2-[3-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-4-isoquinolyl]ethanol Formula: C20H19NO5 MolecularWeight: 353.36856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=NC(=C2CCO)C3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=NC(=C2CCO)C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C20H19NO5/c1-23-17-8-13-10-21-20(12-3-4-16-19(7-12)26-11-25-16)14(5-6-22)15(13)9-18(17)24-2/h3-4,7-10,22H,5-6,11H2,1-2H3