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Details

Stereochemistry ACHIRAL
Molecular Formula C15H15NO3
Molecular Weight 257.2845
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TOLMETIN

SMILES

CN1C(CC(O)=O)=CC=C1C(=O)C2=CC=C(C)C=C2

InChI

InChIKey=UPSPUYADGBWSHF-UHFFFAOYSA-N
InChI=1S/C15H15NO3/c1-10-3-5-11(6-4-10)15(19)13-8-7-12(16(13)2)9-14(17)18/h3-8H,9H2,1-2H3,(H,17,18)

HIDE SMILES / InChI

Molecular Formula C15H15NO3
Molecular Weight 257.2845
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
D8K2JPN18B
Record Status Validated (UNII)
Record Version