3,4-dimethyl-7-nitro-2H-isoquinolin-1-one

Systemtic Name: 3,4-dimethyl-7-nitro-2H-isoquinolin-1-one Openeye Name: 3,4-dimethyl-7-nitro-2H-isoquinolin-1-one CAS Name: 3,4-dimethyl-7-nitro-2H-isoquinolin-1-one IUPAC Name: 3,4-dimethyl-7-nitro-2H-isoquinolin-1-one Traditional Name: 3,4-dimethyl-7-nitro-isocarbostyril Formula: C11H10N2O3 MolecularWeight: 218.2087

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=O)C2=C1C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(NC(=O)C2=C1C=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C11H10N2O3/c1-6-7(2)12-11(14)10-5-8(13(15)16)3-4-9(6)10/h3-5H,1-2H3,(H,12,14)