1-bromanylpropan-2-one; 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene

Systemtic Name: 1-bromanylpropan-2-one; 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene Openeye Name: 1-bromopropan-2-one; 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene CAS Name: 1-bromo-2-propanone; 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene IUPAC Name: 1-bromopropan-2-one; 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene Traditional Name: 1-bromoacetone; 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene Formula: C9H8BrNO3 MolecularWeight: 258.06872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CBr.C1=CC2=C1C=C2[N+](=O)[O-]

Isomeric SMILES

CC(=O)CBr.C1=CC2=C1C=C2[N+](=O)[O-]

InChI

InChI=1S/C6H3NO2.C3H5BrO/c8-7(9)6-3-4-1-2-5(4)6;1-3(5)2-4/h1-3H;2H2,1H3