5-methyl-1,3-dinitro-cyclohexa-1,3-diene

Systemtic Name: 5-methyl-1,3-dinitro-cyclohexa-1,3-diene Openeye Name: 5-methyl-1,3-dinitro-cyclohexa-1,3-diene CAS Name: 5-methyl-1,3-dinitrocyclohexa-1,3-diene IUPAC Name: 5-methyl-1,3-dinitrocyclohexa-1,3-diene Traditional Name: 5-methyl-1,3-dinitro-cyclohexa-1,3-diene Formula: C7H8N2O4 MolecularWeight: 184.14942

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H8N2O4/c1-5-2-6(8(10)11)4-7(3-5)9(12)13/h2,4-5H,3H2,1H3