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

Systemtic Name: 2-bromanyl-3,3-dimethyl-1-[2,3,4,5-tetramethyl-6-(nitromethyl)phenyl]butan-1-one Openeye Name: 2-bromo-3,3-dimethyl-1-[2,3,4,5-tetramethyl-6-(nitromethyl)phenyl]butan-1-one CAS Name: 2-bromo-3,3-dimethyl-1-[2,3,4,5-tetramethyl-6-(nitromethyl)phenyl]-1-butanone IUPAC Name: 2-bromo-3,3-dimethyl-1-[2,3,4,5-tetramethyl-6-(nitromethyl)phenyl]butan-1-one Traditional Name: 2-bromo-3,3-dimethyl-1-[2,3,4,5-tetramethyl-6-(nitromethyl)phenyl]butan-1-one Formula: C17H24BrNO3 MolecularWeight: 370.28136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C[N+](=O)[O-])C(=O)C(C(C)(C)C)Br)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C[N+](=O)[O-])C(=O)C(C(C)(C)C)Br)C)C

InChI

InChI=1S/C17H24BrNO3/c1-9-10(2)12(4)14(13(11(9)3)8-19(21)22)15(20)16(18)17(5,6)7/h16H,8H2,1-7H3