7-ethoxy-6-methoxy-1-methyl-4-nitro-2H-isoquinolin-3-one

Systemtic Name: 7-ethoxy-6-methoxy-1-methyl-4-nitro-2H-isoquinolin-3-one Openeye Name: 7-ethoxy-6-methoxy-1-methyl-4-nitro-2H-isoquinolin-3-one CAS Name: 7-ethoxy-6-methoxy-1-methyl-4-nitro-2H-isoquinolin-3-one IUPAC Name: 7-ethoxy-6-methoxy-1-methyl-4-nitro-2H-isoquinolin-3-one Traditional Name: 7-ethoxy-6-methoxy-1-methyl-4-nitro-3-isoquinolone Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(NC(=O)C(=C2C=C1OC)[N+](=O)[O-])C

Isomeric SMILES

CCOC1=CC2=C(NC(=O)C(=C2C=C1OC)[N+](=O)[O-])C

InChI

InChI=1S/C13H14N2O5/c1-4-20-11-5-8-7(2)14-13(16)12(15(17)18)9(8)6-10(11)19-3/h5-6H,4H2,1-3H3,(H,14,16)