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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H12ClNO3
Molecular Weight 229.66
Optical Activity ( + )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of JBPOS-0101

SMILES

C[C@H](OC(N)=O)[C@@H](O)C1=CC=CC=C1Cl

InChI

InChIKey=TZOWVYPYWJLZTK-IMTBSYHQSA-N
InChI=1S/C10H12ClNO3/c1-6(15-10(12)14)9(13)7-4-2-3-5-8(7)11/h2-6,9,13H,1H3,(H2,12,14)/t6-,9+/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H12ClNO3
Molecular Weight 229.66
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:05:26 GMT 2023
Edited
by admin
on Sat Dec 16 13:05:26 GMT 2023
Record UNII
D7NM51C3GU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
JBPOS-0101
Code English
JBPOS0101
Code English
1,2-PROPANEDIOL, 1-(2-CHLOROPHENYL)-, 2-CARBAMATE, (1S,2S)-
Systematic Name English
1-(2-CHLOROPHENYL)-1-(S)-HYDROXY-2-(S)-CARBAMOYLOXY-PROPANE
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 555216
Created by admin on Sat Dec 16 13:05:26 GMT 2023 , Edited by admin on Sat Dec 16 13:05:26 GMT 2023
FDA ORPHAN DRUG 528216
Created by admin on Sat Dec 16 13:05:26 GMT 2023 , Edited by admin on Sat Dec 16 13:05:26 GMT 2023
Code System Code Type Description
CAS
1353949-71-9
Created by admin on Sat Dec 16 13:05:26 GMT 2023 , Edited by admin on Sat Dec 16 13:05:26 GMT 2023
PRIMARY
FDA UNII
D7NM51C3GU
Created by admin on Sat Dec 16 13:05:26 GMT 2023 , Edited by admin on Sat Dec 16 13:05:26 GMT 2023
PRIMARY
PUBCHEM
57524523
Created by admin on Sat Dec 16 13:05:26 GMT 2023 , Edited by admin on Sat Dec 16 13:05:26 GMT 2023
PRIMARY
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