(2S)-2,5-dimethyl-7-nitro-2,3-dihydro-1H-1,5-benzodiazepin-4-one

Systemtic Name: (2S)-2,5-dimethyl-7-nitro-2,3-dihydro-1H-1,5-benzodiazepin-4-one Openeye Name: (2S)-2,5-dimethyl-7-nitro-2,3-dihydro-1H-1,5-benzodiazepin-4-one CAS Name: (2S)-2,5-dimethyl-7-nitro-2,3-dihydro-1H-1,5-benzodiazepin-4-one IUPAC Name: (2S)-2,5-dimethyl-7-nitro-2,3-dihydro-1H-1,5-benzodiazepin-4-one Traditional Name: (2S)-2,5-dimethyl-7-nitro-2,3-dihydro-1H-1,5-benzodiazepin-4-one Formula: C11H13N3O3 MolecularWeight: 235.23922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)N(C2=C(N1)C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O3/c1-7-5-11(15)13(2)10-6-8(14(16)17)3-4-9(10)12-7/h3-4,6-7,12H,5H2,1-2H3/t7-/m0/s1