3-(6-ethenyl-1,3-benzodioxol-5-yl)-6,7-dimethoxy-2H-isoquinolin-1-one

Systemtic Name: 3-(6-ethenyl-1,3-benzodioxol-5-yl)-6,7-dimethoxy-2H-isoquinolin-1-one Openeye Name: 6,7-dimethoxy-3-(6-vinyl-1,3-benzodioxol-5-yl)-2H-isoquinolin-1-one CAS Name: 3-(6-ethenyl-1,3-benzodioxol-5-yl)-6,7-dimethoxy-2H-isoquinolin-1-one IUPAC Name: 3-(6-ethenyl-1,3-benzodioxol-5-yl)-6,7-dimethoxy-2H-isoquinolin-1-one Traditional Name: 6,7-dimethoxy-3-(6-vinyl-1,3-benzodioxol-5-yl)isocarbostyril Formula: C20H17NO5 MolecularWeight: 351.35268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(NC2=O)C3=CC4=C(C=C3C=C)OCO4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(NC2=O)C3=CC4=C(C=C3C=C)OCO4)OC

InChI

InChI=1S/C20H17NO5/c1-4-11-6-18-19(26-10-25-18)8-13(11)15-5-12-7-16(23-2)17(24-3)9-14(12)20(22)21-15/h4-9H,1,10H2,2-3H3,(H,21,22)