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Details

Stereochemistry MIXED
Molecular Formula C13H16O4
Molecular Weight 236.2637
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CARBOXYIBUPROFEN

SMILES

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

InChI

InChIKey=DIVLBIVDYADZPL-UHFFFAOYSA-N
InChI=1S/C13H16O4/c1-8(12(14)15)7-10-3-5-11(6-4-10)9(2)13(16)17/h3-6,8-9H,7H2,1-2H3,(H,14,15)(H,16,17)

HIDE SMILES / InChI

Molecular Formula C13H16O4
Molecular Weight 236.2637
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
2RI5XR466K
Record Status Validated (UNII)
Record Version