1-bromanyl-5-(dinitromethyl)-2-methoxy-3-nitro-benzene

Systemtic Name: 1-bromanyl-5-(dinitromethyl)-2-methoxy-3-nitro-benzene Openeye Name: 1-bromo-5-(dinitromethyl)-2-methoxy-3-nitro-benzene CAS Name: 1-bromo-5-(dinitromethyl)-2-methoxy-3-nitrobenzene IUPAC Name: 1-bromo-5-(dinitromethyl)-2-methoxy-3-nitrobenzene Traditional Name: 1-bromo-5-(dinitromethyl)-2-methoxy-3-nitro-benzene Formula: C8H6BrN3O7 MolecularWeight: 336.05314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Br)C([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1Br)C([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H6BrN3O7/c1-19-7-5(9)2-4(3-6(7)10(13)14)8(11(15)16)12(17)18/h2-3,8H,1H3