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

Details

Stereochemistry ABSOLUTE
Molecular Formula C17H19NO3
Molecular Weight 285.3377
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-CARBOXYATOMOXETINE

SMILES

CNCC[C@@H](OC1=C(C=CC=C1)C(O)=O)C2=CC=CC=C2

InChI

InChIKey=WYLSYXUAKNRJIP-OAHLLOKOSA-N
InChI=1S/C17H19NO3/c1-18-12-11-15(13-7-3-2-4-8-13)21-16-10-6-5-9-14(16)17(19)20/h2-10,15,18H,11-12H2,1H3,(H,19,20)/t15-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
2-CARBOXYATOMOXETINE
Common Name English
BENZOIC ACID, 2-((1R)-3-(METHYLAMINO)-1-PHENYLPROPOXY)-
Systematic Name English
Code System Code Type Description
PUBCHEM
155928973
Created by admin on Sat Dec 16 02:06:21 GMT 2023 , Edited by admin on Sat Dec 16 02:06:21 GMT 2023
PRIMARY
FDA UNII
W3MJT4D5UD
Created by admin on Sat Dec 16 02:06:21 GMT 2023 , Edited by admin on Sat Dec 16 02:06:21 GMT 2023
PRIMARY
CAS
540729-11-1
Created by admin on Sat Dec 16 02:06:21 GMT 2023 , Edited by admin on Sat Dec 16 02:06:21 GMT 2023
PRIMARY