(7-ethoxy-6-methoxy-1-methyl-4-nitro-isoquinolin-3-yl) ethanoate

Systemtic Name: (7-ethoxy-6-methoxy-1-methyl-4-nitro-isoquinolin-3-yl) ethanoate Openeye Name: (7-ethoxy-6-methoxy-1-methyl-4-nitro-3-isoquinolyl) acetate CAS Name: acetic acid (7-ethoxy-6-methoxy-1-methyl-4-nitro-3-isoquinolinyl) ester IUPAC Name: (7-ethoxy-6-methoxy-1-methyl-4-nitroisoquinolin-3-yl) acetate Traditional Name: acetic acid (7-ethoxy-6-methoxy-1-methyl-4-nitro-3-isoquinolyl) ester Formula: C15H16N2O6 MolecularWeight: 320.29734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC(=C2[N+](=O)[O-])OC(=O)C)C)OC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC(=C2[N+](=O)[O-])OC(=O)C)C)OC

InChI

InChI=1S/C15H16N2O6/c1-5-22-13-6-10-8(2)16-15(23-9(3)18)14(17(19)20)11(10)7-12(13)21-4/h6-7H,5H2,1-4H3