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Details

Stereochemistry ACHIRAL
Molecular Formula C13H14N2O3S
Molecular Weight 278.327
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Propenylcarbamic acid 2-(3-oxo-1,2-benzisothiazol-2(3H)-yl)ethyl ester

SMILES

C=CCNC(=O)OCCN1SC2=C(C=CC=C2)C1=O

InChI

InChIKey=HZRIGGPGVSECKH-UHFFFAOYSA-N
InChI=1S/C13H14N2O3S/c1-2-7-14-13(17)18-9-8-15-12(16)10-5-3-4-6-11(10)19-15/h2-6H,1,7-9H2,(H,14,17)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Carbamic acid, 2-propenyl-, 2-(3-oxo-1,2-benzisothiazol-2(3H)-yl)ethyl ester
Preferred Name English
2-Propenylcarbamic acid 2-(3-oxo-1,2-benzisothiazol-2(3H)-yl)ethyl ester
Systematic Name English
Code System Code Type Description
FDA UNII
7FVK5JY9WS
Created by admin on Mon Mar 31 23:21:38 GMT 2025 , Edited by admin on Mon Mar 31 23:21:38 GMT 2025
PRIMARY
PUBCHEM
9970776
Created by admin on Mon Mar 31 23:21:38 GMT 2025 , Edited by admin on Mon Mar 31 23:21:38 GMT 2025
PRIMARY
CAS
199172-75-3
Created by admin on Mon Mar 31 23:21:38 GMT 2025 , Edited by admin on Mon Mar 31 23:21:38 GMT 2025
PRIMARY
EPA CompTox
DTXSID70941794
Created by admin on Mon Mar 31 23:21:38 GMT 2025 , Edited by admin on Mon Mar 31 23:21:38 GMT 2025
PRIMARY
NIH
NCATS
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