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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H12ClNO3
Molecular Weight 301.724
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENOXAPROFEN, (R)-

SMILES

C[C@@H](C(O)=O)C1=CC2=C(OC(=N2)C3=CC=C(Cl)C=C3)C=C1

InChI

InChIKey=MITFXPHMIHQXPI-SECBINFHSA-N
InChI=1S/C16H12ClNO3/c1-9(16(19)20)11-4-7-14-13(8-11)18-15(21-14)10-2-5-12(17)6-3-10/h2-9H,1H3,(H,19,20)/t9-/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H12ClNO3
Molecular Weight 301.724
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 Sat Dec 16 10:12:40 GMT 2023
Edited
by admin
on Sat Dec 16 10:12:40 GMT 2023
Record UNII
261K1A3F0M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENOXAPROFEN, (R)-
Common Name English
5-BENZOXAZOLEACETIC ACID, 2-(4-CHLOROPHENYL)-.ALPHA.-METHYL-, (.ALPHA.R)-
Systematic Name English
Code System Code Type Description
FDA UNII
261K1A3F0M
Created by admin on Sat Dec 16 10:12:40 GMT 2023 , Edited by admin on Sat Dec 16 10:12:40 GMT 2023
PRIMARY
PUBCHEM
155366
Created by admin on Sat Dec 16 10:12:41 GMT 2023 , Edited by admin on Sat Dec 16 10:12:41 GMT 2023
PRIMARY
CAS
70280-67-0
Created by admin on Sat Dec 16 10:12:40 GMT 2023 , Edited by admin on Sat Dec 16 10:12:40 GMT 2023
PRIMARY
EPA CompTox
DTXSID30220512
Created by admin on Sat Dec 16 10:12:40 GMT 2023 , Edited by admin on Sat Dec 16 10:12:40 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER