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Details

Stereochemistry ACHIRAL
Molecular Formula C17H11NO4S
Molecular Weight 325.339
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Methyl-7-oxo-7H-naphtho[1,2,3-de]quinoline-4-sulfonic acid

SMILES

CC1=CC2=C3C(=CC=C(C3=N1)S(O)(=O)=O)C(=O)C4=CC=CC=C24

InChI

InChIKey=YWVBEIADCVGBHU-UHFFFAOYSA-N
InChI=1S/C17H11NO4S/c1-9-8-13-10-4-2-3-5-11(10)17(19)12-6-7-14(23(20,21)22)16(18-9)15(12)13/h2-8H,1H3,(H,20,21,22)

HIDE SMILES / InChI

Molecular Formula C17H11NO4S
Molecular Weight 325.339
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 Tue Apr 01 18:29:16 GMT 2025
Edited
by admin
on Tue Apr 01 18:29:16 GMT 2025
Record UNII
W9K9E5GY83
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Methyl-7-oxo-7H-naphtho[1,2,3-de]quinoline-4-sulfonic acid
Systematic Name English
7H-Dibenz[f,ij]isoquinoline-4-sulfonic acid, 2-methyl-7-oxo-
Preferred Name English
7H-Naphtho[1,2,3-de]quinoline-4-sulfonic acid, 2-methyl-7-oxo-
Systematic Name English
Code System Code Type Description
FDA UNII
W9K9E5GY83
Created by admin on Tue Apr 01 18:29:16 GMT 2025 , Edited by admin on Tue Apr 01 18:29:16 GMT 2025
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CAS
68239-60-1
Created by admin on Tue Apr 01 18:29:16 GMT 2025 , Edited by admin on Tue Apr 01 18:29:16 GMT 2025
PRIMARY
PUBCHEM
109904
Created by admin on Tue Apr 01 18:29:16 GMT 2025 , Edited by admin on Tue Apr 01 18:29:16 GMT 2025
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EPA CompTox
DTXSID6071326
Created by admin on Tue Apr 01 18:29:16 GMT 2025 , Edited by admin on Tue Apr 01 18:29:16 GMT 2025
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ECHA (EC/EINECS)
269-453-1
Created by admin on Tue Apr 01 18:29:16 GMT 2025 , Edited by admin on Tue Apr 01 18:29:16 GMT 2025
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