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Details

Stereochemistry ACHIRAL
Molecular Formula C10H10N2O4S
Molecular Weight 254.262
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALTERNATIVE DEFINITION for [3-(3-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-1-YL)BENZENESULFONIC ACID]

SMILES

CC1=NN(C(=O)C1)C2=CC=CC(=C2)S(O)(=O)=O

InChI

InChIKey=VEMGKBUHUTYHHA-UHFFFAOYSA-N
InChI=1S/C10H10N2O4S/c1-7-5-10(13)12(11-7)8-3-2-4-9(6-8)17(14,15)16/h2-4,6H,5H2,1H3,(H,14,15,16)

HIDE SMILES / InChI

Approval Year