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

Systemtic Name: 3-bromanylprop-1-yne; 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene Openeye Name: 3-bromoprop-1-yne; 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene CAS Name: 3-bromo-1-propyne; 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene IUPAC Name: 3-bromoprop-1-yne; 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene Traditional Name: 3-bromoprop-1-yne; 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene Formula: C9H6BrNO2 MolecularWeight: 240.05344

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Descriptors Computed from Structure

Canonical SMILES:

C#CCBr.C1=CC2=C1C=C2[N+](=O)[O-]

Isomeric SMILES

C#CCBr.C1=CC2=C1C=C2[N+](=O)[O-]

InChI

InChI=1S/C6H3NO2.C3H3Br/c8-7(9)6-3-4-1-2-5(4)6;1-2-3-4/h1-3H;1H,3H2