1-(dinitromethyl)-2,4-dimethyl-5-nitro-benzene

Systemtic Name: 1-(dinitromethyl)-2,4-dimethyl-5-nitro-benzene Openeye Name: 1-(dinitromethyl)-2,4-dimethyl-5-nitro-benzene CAS Name: 1-(dinitromethyl)-2,4-dimethyl-5-nitrobenzene IUPAC Name: 1-(dinitromethyl)-2,4-dimethyl-5-nitrobenzene Traditional Name: 1-(dinitromethyl)-2,4-dimethyl-5-nitro-benzene Formula: C9H9N3O6 MolecularWeight: 255.18426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9N3O6/c1-5-3-6(2)8(10(13)14)4-7(5)9(11(15)16)12(17)18/h3-4,9H,1-2H3