(8-acetyloxy-1-cyano-7-ethoxy-6-methyl-isoquinolin-5-yl) ethanoate

Systemtic Name: (8-acetyloxy-1-cyano-7-ethoxy-6-methyl-isoquinolin-5-yl) ethanoate Openeye Name: (8-acetoxy-1-cyano-7-ethoxy-6-methyl-5-isoquinolyl) acetate CAS Name: acetic acid (8-acetyloxy-1-cyano-7-ethoxy-6-methyl-5-isoquinolinyl) ester IUPAC Name: (8-acetyloxy-1-cyano-7-ethoxy-6-methylisoquinolin-5-yl) acetate Traditional Name: acetic acid (8-acetoxy-1-cyano-7-ethoxy-6-methyl-5-isoquinolyl) ester Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=C(C=CN=C2C#N)C(=C1C)OC(=O)C)OC(=O)C

Isomeric SMILES

CCOC1=C(C2=C(C=CN=C2C#N)C(=C1C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C17H16N2O5/c1-5-22-16-9(2)15(23-10(3)20)12-6-7-19-13(8-18)14(12)17(16)24-11(4)21/h6-7H,5H2,1-4H3