U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C12H11ClN2O
Molecular Weight 234.682
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Chloro-4-(2-pyridylmethoxy)aniline

SMILES

NC1=CC(Cl)=C(OCC2=CC=CC=N2)C=C1

InChI

InChIKey=XCAPJQSICQSUJP-UHFFFAOYSA-N
InChI=1S/C12H11ClN2O/c13-11-7-9(14)4-5-12(11)16-8-10-3-1-2-6-15-10/h1-7H,8,14H2

HIDE SMILES / InChI

Molecular Formula C12H11ClN2O
Molecular Weight 234.682
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 18:44:28 GMT 2023
Edited
by admin
on Sat Dec 16 18:44:28 GMT 2023
Record UNII
67KD7Z8H49
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Chloro-4-(2-pyridylmethoxy)aniline
Systematic Name English
3-Chloro-4-(2-pyridinylmethoxy)benzenamine
Systematic Name English
Benzenamine, 3-chloro-4-(2-pyridinylmethoxy)-
Systematic Name English
Code System Code Type Description
FDA UNII
67KD7Z8H49
Created by admin on Sat Dec 16 18:44:28 GMT 2023 , Edited by admin on Sat Dec 16 18:44:28 GMT 2023
PRIMARY
PUBCHEM
16781212
Created by admin on Sat Dec 16 18:44:28 GMT 2023 , Edited by admin on Sat Dec 16 18:44:28 GMT 2023
PRIMARY
CAS
524955-09-7
Created by admin on Sat Dec 16 18:44:28 GMT 2023 , Edited by admin on Sat Dec 16 18:44:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID80588396
Created by admin on Sat Dec 16 18:44:28 GMT 2023 , Edited by admin on Sat Dec 16 18:44:28 GMT 2023
PRIMARY