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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(C[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

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