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Details

Stereochemistry ACHIRAL
Molecular Formula C14H12ClNO3
Molecular Weight 277.703
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-((3-CHLORANYL-2-(HYDROXYMETHYL)PHENYL)AMINO)BENZOIC ACID

SMILES

OCC1=C(NC2=C(C=CC=C2)C(O)=O)C=CC=C1Cl

InChI

InChIKey=BMLZYLYIEWXTCM-UHFFFAOYSA-N
InChI=1S/C14H12ClNO3/c15-11-5-3-7-13(10(11)8-17)16-12-6-2-1-4-9(12)14(18)19/h1-7,16-17H,8H2,(H,18,19)

HIDE SMILES / InChI

Molecular Formula C14H12ClNO3
Molecular Weight 277.703
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 08:03:21 GMT 2025
Edited
by admin
on Wed Apr 02 08:03:21 GMT 2025
Record UNII
65A70DKY8V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-((3-CHLORANYL-2-(HYDROXYMETHYL)PHENYL)AMINO)BENZOIC ACID
Preferred Name English
Code System Code Type Description
CAS
77605-72-2
Created by admin on Wed Apr 02 08:03:21 GMT 2025 , Edited by admin on Wed Apr 02 08:03:21 GMT 2025
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PUBCHEM
53703
Created by admin on Wed Apr 02 08:03:21 GMT 2025 , Edited by admin on Wed Apr 02 08:03:21 GMT 2025
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EPA CompTox
DTXSID30228270
Created by admin on Wed Apr 02 08:03:21 GMT 2025 , Edited by admin on Wed Apr 02 08:03:21 GMT 2025
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FDA UNII
65A70DKY8V
Created by admin on Wed Apr 02 08:03:21 GMT 2025 , Edited by admin on Wed Apr 02 08:03:21 GMT 2025
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