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Details

Stereochemistry ACHIRAL
Molecular Formula C17H18ClNO3
Molecular Weight 319.783
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 5-(4-CHLOROBENZOYL)-1,4-DIMETHYLPYRROLE-2-ACETATE

SMILES

CCOC(=O)CC1=CC(C)=C(N1C)C(=O)C2=CC=C(Cl)C=C2

InChI

InChIKey=AGKFMUXEONTGAH-UHFFFAOYSA-N
InChI=1S/C17H18ClNO3/c1-4-22-15(20)10-14-9-11(2)16(19(14)3)17(21)12-5-7-13(18)8-6-12/h5-9H,4,10H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C17H18ClNO3
Molecular Weight 319.783
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 Sat Dec 16 12:18:28 GMT 2023
Edited
by admin
on Sat Dec 16 12:18:28 GMT 2023
Record UNII
KKX9XE8BY2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL 5-(4-CHLOROBENZOYL)-1,4-DIMETHYLPYRROLE-2-ACETATE
Common Name English
ETHYL 5-(P-CHLOROBENZOYL)-1,4-DIMETHYLPYRROLE-2-ACETATE
Common Name English
1H-PYRROLE-2-ACETIC ACID, 5-(4-CHLOROBENZOYL)-1,4-DIMETHYL-, ETHYL ESTER
Systematic Name English
ETHYL 5-(4-CHLOROBENZOYL)-1,4-DIMETHYL-1H-PYRROLE-2-ACETATE
Systematic Name English
ETHYL 5-(4-CHLOROBENZOYL)-1,4-DIMETHYL-PYRROLE-2-ACETATE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID10186985
Created by admin on Sat Dec 16 12:18:28 GMT 2023 , Edited by admin on Sat Dec 16 12:18:28 GMT 2023
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FDA UNII
KKX9XE8BY2
Created by admin on Sat Dec 16 12:18:28 GMT 2023 , Edited by admin on Sat Dec 16 12:18:28 GMT 2023
PRIMARY
CAS
33369-30-1
Created by admin on Sat Dec 16 12:18:28 GMT 2023 , Edited by admin on Sat Dec 16 12:18:28 GMT 2023
PRIMARY
PUBCHEM
118463
Created by admin on Sat Dec 16 12:18:28 GMT 2023 , Edited by admin on Sat Dec 16 12:18:28 GMT 2023
PRIMARY
ECHA (EC/EINECS)
251-473-7
Created by admin on Sat Dec 16 12:18:28 GMT 2023 , Edited by admin on Sat Dec 16 12:18:28 GMT 2023
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