2-bromanyl-1-[2,3,4,5-tetramethyl-6-(nitromethyl)phenyl]pentan-1-one

Systemtic Name: 2-bromanyl-1-[2,3,4,5-tetramethyl-6-(nitromethyl)phenyl]pentan-1-one Openeye Name: 2-bromo-1-[2,3,4,5-tetramethyl-6-(nitromethyl)phenyl]pentan-1-one CAS Name: 2-bromo-1-[2,3,4,5-tetramethyl-6-(nitromethyl)phenyl]-1-pentanone IUPAC Name: 2-bromo-1-[2,3,4,5-tetramethyl-6-(nitromethyl)phenyl]pentan-1-one Traditional Name: 2-bromo-1-[2,3,4,5-tetramethyl-6-(nitromethyl)phenyl]pentan-1-one Formula: C16H22BrNO3 MolecularWeight: 356.25478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22BrNO3/c1-6-7-14(17)16(19)15-12(5)10(3)9(2)11(4)13(15)8-18(20)21/h14H,6-8H2,1-5H3