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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H15ClO4
Molecular Weight 342.773
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of COUMACHLOR, (+)-

SMILES

CC(=O)C[C@H](C1=CC=C(Cl)C=C1)C2=C(O)C3=C(OC2=O)C=CC=C3

InChI

InChIKey=DEKWZWCFHUABHE-OAHLLOKOSA-N
InChI=1S/C19H15ClO4/c1-11(21)10-15(12-6-8-13(20)9-7-12)17-18(22)14-4-2-3-5-16(14)24-19(17)23/h2-9,15,22H,10H2,1H3/t15-/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H15ClO4
Molecular Weight 342.773
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:46:30 GMT 2023
Edited
by admin
on Sat Dec 16 10:46:30 GMT 2023
Record UNII
MN6G9XL8YS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
COUMACHLOR, (+)-
Common Name English
(R)-4-CHLOROWARFARIN
Common Name English
2H-1-BENZOPYRAN-2-ONE, 3-((1R)-1-(4-CHLOROPHENYL)-3-OXOBUTYL)-4-HYDROXY-
Systematic Name English
(R)-P-CHLOROWARFARIN
Common Name English
(R)-COUMACHLOR
Common Name English
(R)-3-(.ALPHA.-ACETONYL-4-CHLOROBENZYL)-4-HYDROXYCOUMARIN
Systematic Name English
(+)-COUMACHLOR
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID101323989
Created by admin on Sat Dec 16 10:46:30 GMT 2023 , Edited by admin on Sat Dec 16 10:46:30 GMT 2023
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FDA UNII
MN6G9XL8YS
Created by admin on Sat Dec 16 10:46:30 GMT 2023 , Edited by admin on Sat Dec 16 10:46:30 GMT 2023
PRIMARY
PUBCHEM
54704925
Created by admin on Sat Dec 16 10:46:30 GMT 2023 , Edited by admin on Sat Dec 16 10:46:30 GMT 2023
PRIMARY
CAS
95271-89-9
Created by admin on Sat Dec 16 10:46:30 GMT 2023 , Edited by admin on Sat Dec 16 10:46:30 GMT 2023
PRIMARY