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Details

Stereochemistry ACHIRAL
Molecular Formula C10H13NO4
Molecular Weight 211.2145
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 3-carboxy-1,4-dimethyl-1H-pyrrole-2-acetate

SMILES

COC(=O)CC1=C(C(O)=O)C(C)=CN1C

InChI

InChIKey=CEDSJOYSTAOUQU-UHFFFAOYSA-N
InChI=1S/C10H13NO4/c1-6-5-11(2)7(4-8(12)15-3)9(6)10(13)14/h5H,4H2,1-3H3,(H,13,14)

HIDE SMILES / InChI

Molecular Formula C10H13NO4
Molecular Weight 211.2145
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:10:09 GMT 2025
Edited
by admin
on Tue Apr 01 19:10:09 GMT 2025
Record UNII
ME9S87HDW6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Methyl 3-carboxy-1,4-dimethyl-1H-pyrrole-2-acetate
Systematic Name English
1H-Pyrrole-2-acetic acid, 3-carboxy-1,4-dimethyl-, 2-methyl ester
Preferred Name English
2-Methyl 3-carboxy-1,4-dimethyl-1H-pyrrole-2-acetate
Systematic Name English
Code System Code Type Description
PUBCHEM
12536083
Created by admin on Tue Apr 01 19:10:09 GMT 2025 , Edited by admin on Tue Apr 01 19:10:09 GMT 2025
PRIMARY
EPA CompTox
DTXSID20222242
Created by admin on Tue Apr 01 19:10:09 GMT 2025 , Edited by admin on Tue Apr 01 19:10:09 GMT 2025
PRIMARY
FDA UNII
ME9S87HDW6
Created by admin on Tue Apr 01 19:10:09 GMT 2025 , Edited by admin on Tue Apr 01 19:10:09 GMT 2025
PRIMARY
CAS
71959-95-0
Created by admin on Tue Apr 01 19:10:09 GMT 2025 , Edited by admin on Tue Apr 01 19:10:09 GMT 2025
PRIMARY
ECHA (EC/EINECS)
276-208-2
Created by admin on Tue Apr 01 19:10:09 GMT 2025 , Edited by admin on Tue Apr 01 19:10:09 GMT 2025
PRIMARY