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Details

Stereochemistry ACHIRAL
Molecular Formula C8H8ClNO2
Molecular Weight 185.608
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 3-amino-5-chlorobenzoate

SMILES

COC(=O)C1=CC(N)=CC(Cl)=C1

InChI

InChIKey=ORKTXZHKYFWCRB-UHFFFAOYSA-N
InChI=1S/C8H8ClNO2/c1-12-8(11)5-2-6(9)4-7(10)3-5/h2-4H,10H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Methyl 3-amino-5-chlorobenzoate
Systematic Name English
3-Amino-5-chlorobenzoic acid methyl ester
Preferred Name English
Benzoic acid, 3-amino-5-chloro-, methyl ester
Systematic Name English
5-Carbomethoxy-3-chloroaniline
Systematic Name English
Code System Code Type Description
PUBCHEM
52987785
Created by admin on Wed Apr 02 20:55:11 GMT 2025 , Edited by admin on Wed Apr 02 20:55:11 GMT 2025
PRIMARY
FDA UNII
BXY3XQ3GU9
Created by admin on Wed Apr 02 20:55:11 GMT 2025 , Edited by admin on Wed Apr 02 20:55:11 GMT 2025
PRIMARY
CAS
21961-31-9
Created by admin on Wed Apr 02 20:55:11 GMT 2025 , Edited by admin on Wed Apr 02 20:55:11 GMT 2025
PRIMARY
NIH
NCATS
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