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Details

Stereochemistry ACHIRAL
Molecular Formula C14H12N2O5S
Molecular Weight 320.32
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-(4,5-Dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-3-hydroxy-1-naphthalenesulfonic acid

SMILES

CC1=NN(C(=O)C1)C2=CC3=C(C=C(O)C=C3C=C2)S(O)(=O)=O

InChI

InChIKey=GZMUIZGBSSTJPC-UHFFFAOYSA-N
InChI=1S/C14H12N2O5S/c1-8-4-14(18)16(15-8)10-3-2-9-5-11(17)7-13(12(9)6-10)22(19,20)21/h2-3,5-7,17H,4H2,1H3,(H,19,20,21)

HIDE SMILES / InChI

Molecular Formula C14H12N2O5S
Molecular Weight 320.32
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:52:21 GMT 2023
Edited
by admin
on Sat Dec 16 12:52:21 GMT 2023
Record UNII
4D224KJ2GA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-(4,5-Dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-3-hydroxy-1-naphthalenesulfonic acid
Systematic Name English
1-Naphthalenesulfonic acid, 7-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-3-hydroxy-
Common Name English
Code System Code Type Description
FDA UNII
4D224KJ2GA
Created by admin on Sat Dec 16 12:52:21 GMT 2023 , Edited by admin on Sat Dec 16 12:52:21 GMT 2023
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PUBCHEM
173416
Created by admin on Sat Dec 16 12:52:21 GMT 2023 , Edited by admin on Sat Dec 16 12:52:21 GMT 2023
PRIMARY
EPA CompTox
DTXSID9072812
Created by admin on Sat Dec 16 12:52:21 GMT 2023 , Edited by admin on Sat Dec 16 12:52:21 GMT 2023
PRIMARY
ECHA (EC/EINECS)
278-218-2
Created by admin on Sat Dec 16 12:52:21 GMT 2023 , Edited by admin on Sat Dec 16 12:52:21 GMT 2023
PRIMARY
CAS
75476-93-6
Created by admin on Sat Dec 16 12:52:21 GMT 2023 , Edited by admin on Sat Dec 16 12:52:21 GMT 2023
PRIMARY