1-(2,2-dinitroethyl)-4-nitro-benzene

Systemtic Name: 1-(2,2-dinitroethyl)-4-nitro-benzene Openeye Name: 1-(2,2-dinitroethyl)-4-nitro-benzene CAS Name: 1-(2,2-dinitroethyl)-4-nitrobenzene IUPAC Name: 1-(2,2-dinitroethyl)-4-nitrobenzene Traditional Name: 1-(2,2-dinitroethyl)-4-nitro-benzene Formula: C8H7N3O6 MolecularWeight: 241.15768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H7N3O6/c12-9(13)7-3-1-6(2-4-7)5-8(10(14)15)11(16)17/h1-4,8H,5H2