(2-bromanyl-1-deuterio-1-phenyl-ethyl) nitrate

Systemtic Name: (2-bromanyl-1-deuterio-1-phenyl-ethyl) nitrate Openeye Name: (2-bromo-1-deuterio-1-phenyl-ethyl) nitrate CAS Name: nitric acid (2-bromo-1-deuterio-1-phenylethyl) ester IUPAC Name: (2-bromo-1-deuterio-1-phenylethyl) nitrate Traditional Name: nitric acid (2-bromo-1-deuterio-1-phenyl-ethyl) ester Formula: C8H8BrNO3 MolecularWeight: 247.064182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[2H]C(CBr)(C1=CC=CC=C1)O[N+](=O)[O-]

InChI

InChI=1S/C8H8BrNO3/c9-6-8(13-10(11)12)7-4-2-1-3-5-7/h1-5,8H,6H2/i8D