1-nitro-3,5-bis(nitromethyl)benzene

Systemtic Name: 1-nitro-3,5-bis(nitromethyl)benzene Openeye Name: 1-nitro-3,5-bis(nitromethyl)benzene CAS Name: 1-nitro-3,5-bis(nitromethyl)benzene IUPAC Name: 1-nitro-3,5-bis(nitromethyl)benzene Traditional Name: 1-nitro-3,5-bis(nitromethyl)benzene Formula: C8H7N3O6 MolecularWeight: 241.15768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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