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Details

Stereochemistry ACHIRAL
Molecular Formula C15H17NO4
Molecular Weight 275.2998
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(Phenylmethyl) 4-ethyl-2,5-dihydro-1H-pyrrole-1,3-dicarboxylate

SMILES

CCC1=C(CN(C1)C(=O)OCC2=CC=CC=C2)C(O)=O

InChI

InChIKey=HFBYGZWWAMZBID-UHFFFAOYSA-N
InChI=1S/C15H17NO4/c1-2-12-8-16(9-13(12)14(17)18)15(19)20-10-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,17,18)

HIDE SMILES / InChI

Molecular Formula C15H17NO4
Molecular Weight 275.2998
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 Wed Apr 02 18:27:28 GMT 2025
Edited
by admin
on Wed Apr 02 18:27:28 GMT 2025
Record UNII
SB92A73Z74
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(Phenylmethyl) 4-ethyl-2,5-dihydro-1H-pyrrole-1,3-dicarboxylate
Systematic Name English
1-((Benzyloxy)carbonyl)-4-ethyl-2,5-dihydro-1H-pyrrole-3-carboxylic acid
Preferred Name English
1H-Pyrrole-1,3-dicarboxylic acid, 4-ethyl-2,5-dihydro-, 1-(phenylmethyl) ester
Systematic Name English
Code System Code Type Description
FDA UNII
SB92A73Z74
Created by admin on Wed Apr 02 18:27:28 GMT 2025 , Edited by admin on Wed Apr 02 18:27:28 GMT 2025
PRIMARY
PUBCHEM
129031087
Created by admin on Wed Apr 02 18:27:28 GMT 2025 , Edited by admin on Wed Apr 02 18:27:28 GMT 2025
PRIMARY
EPA CompTox
DTXSID001137343
Created by admin on Wed Apr 02 18:27:28 GMT 2025 , Edited by admin on Wed Apr 02 18:27:28 GMT 2025
PRIMARY
CAS
1869118-25-1
Created by admin on Wed Apr 02 18:27:28 GMT 2025 , Edited by admin on Wed Apr 02 18:27:28 GMT 2025
PRIMARY
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