Concept information
Preferred term
3 [2 chloro 4 (methylsulfonyl)benzoyl] 4 (phenylthio)bicyclo[3.2.1]oct 3 en 2 one
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
Narrower concepts
charge
- 0
formula
- C22H19ClO4S2
inchi
- InChI=1S/C22H19ClO4S2/c1-29(26,27)16-9-10-17(18(23)12-16)21(25)19-20(24)13-7-8-14(11-13)22(19)28-15-5-3-2-4-6-15/h2-6,9-10,12-14H,7-8,11H2,1H3
inchikey
- VIXCLRUCUMWJFF-UHFFFAOYSA-N
mass
- 446.970
monoisotopicmass
- 446.04133
smiles
- C1CC2C(C(=C(C1C2)SC3=CC=CC=C3)C(C4=CC=C(C=C4Cl)S(C)(=O)=O)=O)=O
subset
- 3_STAR
synonym EXACT
- 3-[2-chloro-4-(methylsulfonyl)benzoyl]-4-(phenylthio)bicyclo[3.2.1]oct-3-en-2-one
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:136658
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