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Concept information

... > organooxygen compound > carbonyl compound > ketone > haloketone > alpha-haloketone > alpha-bromoketone > 2-bromo-2-/{[(4-methylphenyl)sulfonyl]methyl/}-1-indanone
... > organooxygen compound > carbonyl compound > ketone > haloketone > bromoketone > alpha-bromoketone > 2-bromo-2-/{[(4-methylphenyl)sulfonyl]methyl/}-1-indanone
... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > indanones > 2-bromo-2-/{[(4-methylphenyl)sulfonyl]methyl/}-1-indanone

Preferred term

2-bromo-2-/{[(4-methylphenyl)sulfonyl]methyl/}-1-indanone  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C17H15BrO3S

inchi

  • InChI=1S/C17H15BrO3S/c1-12-6-8-14(9-7-12)22(20,21)11-17(18)10-13-4-2-3-5-15(13)16(17)19/h2-9H,10-11H2,1H3

inchikey

  • XPXBWHGWVJYCKM-UHFFFAOYSA-N

mass

  • 379.26800

monoisotopicmass

  • 377.99253

smiles

  • Cc1ccc(cc1)S(=O)(=O)CC1(Br)Cc2ccccc2C1=O

subset

  • 3_STAR

synonym EXACT

  • 2-bromo-2-[(4-methylbenzene-1-sulfonyl)methyl]-2,3-dihydro-1H-inden-1-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:85613

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