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

Details

Stereochemistry ACHIRAL
Molecular Formula C19H23NO3
Molecular Weight 313.3908
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(1-ADAMANTANOYL)-O-AMINOPHENYLACETIC ACID

SMILES

OC(=O)CC1=C(NC(=O)C23CC4CC(CC(C4)C2)C3)C=CC=C1

InChI

InChIKey=TZEMORZNNBGJFF-UHFFFAOYSA-N
InChI=1S/C19H23NO3/c21-17(22)8-15-3-1-2-4-16(15)20-18(23)19-9-12-5-13(10-19)7-14(6-12)11-19/h1-4,12-14H,5-11H2,(H,20,23)(H,21,22)

HIDE SMILES / InChI

Molecular Formula C19H23NO3
Molecular Weight 313.3908
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 Fri Dec 15 15:18:31 GMT 2023
Edited
by admin
on Fri Dec 15 15:18:31 GMT 2023
Record UNII
QV1RAD7UIJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(1-ADAMANTANOYL)-O-AMINOPHENYLACETIC ACID
Systematic Name English
(2-(1-ADAMANTYLCARBOXAMIDO)PHENYLACETIC ACID
Common Name English
BENZENEACETIC ACID, 2-((TRICYCLO(3.3.1.13,7)DEC-1-YLCARBONYL)AMINO)-
Common Name English
ACETIC ACID, (O-1-ADAMANTANECARBOXAMIDOPHENYL)-
Systematic Name English
Code System Code Type Description
CAS
29640-87-7
Created by admin on Fri Dec 15 15:18:31 GMT 2023 , Edited by admin on Fri Dec 15 15:18:31 GMT 2023
PRIMARY
FDA UNII
QV1RAD7UIJ
Created by admin on Fri Dec 15 15:18:31 GMT 2023 , Edited by admin on Fri Dec 15 15:18:31 GMT 2023
PRIMARY
PUBCHEM
91618145
Created by admin on Fri Dec 15 15:18:31 GMT 2023 , Edited by admin on Fri Dec 15 15:18:31 GMT 2023
PRIMARY