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Details

Stereochemistry RACEMIC
Molecular Formula C12H13NO5
Molecular Weight 251.2353
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-METHYL-5-((2-OXO-5-OXAZOLIDINYL)METHOXY)BENZOIC ACID

SMILES

CC1=CC(OCC2CNC(=O)O2)=CC(=C1)C(O)=O

InChI

InChIKey=CCDRNXIYZLKSQD-UHFFFAOYSA-N
InChI=1S/C12H13NO5/c1-7-2-8(11(14)15)4-9(3-7)17-6-10-5-13-12(16)18-10/h2-4,10H,5-6H2,1H3,(H,13,16)(H,14,15)

HIDE SMILES / InChI

Molecular Formula C12H13NO5
Molecular Weight 251.2353
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 16:24:11 GMT 2025
Edited
by admin
on Tue Apr 01 16:24:11 GMT 2025
Record UNII
EE1CLZ54US
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZOIC ACID, 3-METHYL-5-((2-OXO-5-OXAZOLIDINYL)METHOXY)-
Preferred Name English
3-METHYL-5-((2-OXO-5-OXAZOLIDINYL)METHOXY)BENZOIC ACID
Systematic Name English
M-ANISIC ACID, 5-METHYL-.ALPHA.-(2-OXO-5-OXAZOLIDINYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
EE1CLZ54US
Created by admin on Tue Apr 01 16:24:11 GMT 2025 , Edited by admin on Tue Apr 01 16:24:11 GMT 2025
PRIMARY
PUBCHEM
57431536
Created by admin on Tue Apr 01 16:24:11 GMT 2025 , Edited by admin on Tue Apr 01 16:24:11 GMT 2025
PRIMARY
CAS
5057-74-9
Created by admin on Tue Apr 01 16:24:11 GMT 2025 , Edited by admin on Tue Apr 01 16:24:11 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> METABOLITE