2-methyl-5,7-dinitro-1H-quinazolin-4-one

Systemtic Name: 2-methyl-5,7-dinitro-1H-quinazolin-4-one Openeye Name: 2-methyl-5,7-dinitro-1H-quinazolin-4-one CAS Name: 2-methyl-5,7-dinitro-1H-quinazolin-4-one IUPAC Name: 2-methyl-5,7-dinitro-1H-quinazolin-4-one Traditional Name: 2-methyl-5,7-dinitro-1H-quinazolin-4-one Formula: C9H6N4O5 MolecularWeight: 250.16774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=C(C=C(C=C2N1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=O)C2=C(C=C(C=C2N1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H6N4O5/c1-4-10-6-2-5(12(15)16)3-7(13(17)18)8(6)9(14)11-4/h2-3H,1H3,(H,10,11,14)