6-methyl-5,7,8-trinitro-1,4-dihydroquinoxaline-2,3-dione

Systemtic Name: 6-methyl-5,7,8-trinitro-1,4-dihydroquinoxaline-2,3-dione Openeye Name: 6-methyl-5,7,8-trinitro-1,4-dihydroquinoxaline-2,3-dione CAS Name: 6-methyl-5,7,8-trinitro-1,4-dihydroquinoxaline-2,3-dione IUPAC Name: 6-methyl-5,7,8-trinitro-1,4-dihydroquinoxaline-2,3-dione Traditional Name: 6-methyl-5,7,8-trinitro-1,4-dihydroquinoxaline-2,3-quinone Formula: C9H5N5O8 MolecularWeight: 311.1647

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])NC(=O)C(=O)N2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])NC(=O)C(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C9H5N5O8/c1-2-5(12(17)18)3-4(11-9(16)8(15)10-3)7(14(21)22)6(2)13(19)20/h1H3,(H,10,15)(H,11,16)