(3S)-3-methyl-7-nitro-3,4-dihydro-2H-isoquinolin-1-one

Systemtic Name: (3S)-3-methyl-7-nitro-3,4-dihydro-2H-isoquinolin-1-one Openeye Name: (3S)-3-methyl-7-nitro-3,4-dihydro-2H-isoquinolin-1-one CAS Name: (3S)-3-methyl-7-nitro-3,4-dihydro-2H-isoquinolin-1-one IUPAC Name: (3S)-3-methyl-7-nitro-3,4-dihydro-2H-isoquinolin-1-one Traditional Name: (3S)-3-methyl-7-nitro-3,4-dihydroisocarbostyril Formula: C10H10N2O3 MolecularWeight: 206.198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N1

Isomeric SMILES

C[C@H]1CC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N1

InChI

InChI=1S/C10H10N2O3/c1-6-4-7-2-3-8(12(14)15)5-9(7)10(13)11-6/h2-3,5-6H,4H2,1H3,(H,11,13)/t6-/m0/s1