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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H21NO4
Molecular Weight 327.3743
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ?-(Aminomethyl)-4-[[(2,4-dimethylbenzoyl)oxy]methyl]benzeneacetic acid, (?S)-

SMILES

CC1=CC(C)=C(C=C1)C(=O)OCC2=CC=C(C=C2)[C@@H](CN)C(O)=O

InChI

InChIKey=GUDPGGCYIAECJM-QGZVFWFLSA-N
InChI=1S/C19H21NO4/c1-12-3-8-16(13(2)9-12)19(23)24-11-14-4-6-15(7-5-14)17(10-20)18(21)22/h3-9,17H,10-11,20H2,1-2H3,(H,21,22)/t17-/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H21NO4
Molecular Weight 327.3743
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 15:40:22 GMT 2025
Edited
by admin
on Wed Apr 02 15:40:22 GMT 2025
Record UNII
Z3G2EY5AAL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(?S)-?-(Aminomethyl)-4-[[(2,4-dimethylbenzoyl)oxy]methyl]benzeneacetic acid
Preferred Name English
?-(Aminomethyl)-4-[[(2,4-dimethylbenzoyl)oxy]methyl]benzeneacetic acid, (?S)-
Common Name English
Benzeneacetic acid, ?-(aminomethyl)-4-[[(2,4-dimethylbenzoyl)oxy]methyl]-, (?S)-
Systematic Name English
Code System Code Type Description
CAS
2684301-49-1
Created by admin on Wed Apr 02 15:40:22 GMT 2025 , Edited by admin on Wed Apr 02 15:40:22 GMT 2025
PRIMARY
PUBCHEM
166177282
Created by admin on Wed Apr 02 15:40:22 GMT 2025 , Edited by admin on Wed Apr 02 15:40:22 GMT 2025
PRIMARY
FDA UNII
Z3G2EY5AAL
Created by admin on Wed Apr 02 15:40:22 GMT 2025 , Edited by admin on Wed Apr 02 15:40:22 GMT 2025
PRIMARY