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Details

Stereochemistry ACHIRAL
Molecular Formula C19H20ClNO4
Molecular Weight 361.819
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(4-(2-((5-CHLORANYL-2-METHOXY-PHENYL)CARBONYLAMINO)ETHYL)PHENYL)PROPANOIC ACID

SMILES

COC1=C(C=C(Cl)C=C1)C(=O)NCCC2=CC=C(CCC(O)=O)C=C2

InChI

InChIKey=AIEFQKOARQRACO-UHFFFAOYSA-N
InChI=1S/C19H20ClNO4/c1-25-17-8-7-15(20)12-16(17)19(24)21-11-10-14-4-2-13(3-5-14)6-9-18(22)23/h2-5,7-8,12H,6,9-11H2,1H3,(H,21,24)(H,22,23)

HIDE SMILES / InChI

Molecular Formula C19H20ClNO4
Molecular Weight 361.819
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 15:46:21 GMT 2023
Edited
by admin
on Sat Dec 16 15:46:21 GMT 2023
Record UNII
M25WHQ3TKC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(4-(2-((5-CHLORANYL-2-METHOXY-PHENYL)CARBONYLAMINO)ETHYL)PHENYL)PROPANOIC ACID
Systematic Name English
NSC-319745
Code English
HB-093
Code English
4-[2-[(5-Chloro-2-methoxybenzoyl)amino]ethyl]benzenepropanoic acid
Systematic Name English
Benzenepropanoic acid, 4-[2-[(5-chloro-2-methoxybenzoyl)amino]ethyl]-
Systematic Name English
Code System Code Type Description
CAS
61629-60-5
Created by admin on Sat Dec 16 15:46:21 GMT 2023 , Edited by admin on Sat Dec 16 15:46:21 GMT 2023
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EPA CompTox
DTXSID00210642
Created by admin on Sat Dec 16 15:46:21 GMT 2023 , Edited by admin on Sat Dec 16 15:46:21 GMT 2023
PRIMARY
NSC
319745
Created by admin on Sat Dec 16 15:46:21 GMT 2023 , Edited by admin on Sat Dec 16 15:46:21 GMT 2023
PRIMARY
PUBCHEM
43709
Created by admin on Sat Dec 16 15:46:21 GMT 2023 , Edited by admin on Sat Dec 16 15:46:21 GMT 2023
PRIMARY
FDA UNII
M25WHQ3TKC
Created by admin on Sat Dec 16 15:46:21 GMT 2023 , Edited by admin on Sat Dec 16 15:46:21 GMT 2023
PRIMARY