2-[2-nitro-4-(trifluoromethyl)phenyl]sulfinylacetic acid (4-chlorophenyl) ester (Q27165671)

MLS000536845 (English)

9 October 2016

chemical formula

C₁₅H₉ClF₃NO₅S

1 reference

MLS000536845 (English)

9 October 2016

canonical SMILES

C1=CC(=CC=C1OC(=O)CS(=O)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])Cl

1 reference

MLS000536845 (English)

InChI=1S/C15H9ClF3NO5S/c16-10-2-4-11(5-3-10)25-14(21)8-26(24)13-6-1-9(15(17,18)19)7-12(13)20(22)23/h1-7H,8H2

9 October 2016

Identifiers

InChI

1 reference

MLS000536845 (English)

QYOVKDKSKVPVHI-UHFFFAOYSA-N

9 October 2016

InChIKey

2 references

MLS000536845 (English)

9 October 2016

stated in

ChEBI release 2020-09-01

1 reference

4-Chlorophenyl {[2-nitro-4-(trifluoromethyl)phenyl]sulfinyl}acetate (English)

9 October 2016

1 reference

MLS000536845 (English)

9 October 2016

ChEBI ID

93918

mapping relation type

1 reference

2-[2-nitro-4-(trifluoromethyl)phenyl]sulfinylacetic acid (4-chlorophenyl) ester (English)

9 October 2016

1 reference