1,2-dimethyl-3,4,5-trinitro-benzene

Systemtic Name: 1,2-dimethyl-3,4,5-trinitro-benzene Openeye Name: 1,2-dimethyl-3,4,5-trinitro-benzene CAS Name: 1,2-dimethyl-3,4,5-trinitrobenzene IUPAC Name: 1,2-dimethyl-3,4,5-trinitrobenzene Traditional Name: 1,2-dimethyl-3,4,5-trinitro-benzene Formula: C8H7N3O6 MolecularWeight: 241.15768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H7N3O6/c1-4-3-6(9(12)13)8(11(16)17)7(5(4)2)10(14)15/h3H,1-2H3