1-methyl-2,3-dinitro-benzene

Systemtic Name: 1-methyl-2,3-dinitro-benzene Openeye Name: 1-methyl-2,3-dinitro-benzene CAS Name: 1-methyl-2,3-dinitrobenzene IUPAC Name: 1-methyl-2,3-dinitrobenzene Traditional Name: 1-methyl-2,3-dinitro-benzene Formula: C14H12N4O8 MolecularWeight: 364.26708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])[N+](=O)[O-].CC1=C(C(=CC=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])[N+](=O)[O-].CC1=C(C(=CC=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/2C7H6N2O4/c2*1-5-3-2-4-6(8(10)11)7(5)9(12)13/h2*2-4H,1H3