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Details

Stereochemistry ACHIRAL
Molecular Formula C20H12ClNO8S3
Molecular Weight 525.959
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[9-Chloro-3-(sulfooxy)naphtho[1,2-b]thien-2-yl]-1H-indol-3-yl hydrogen sulfate

SMILES

OS(=O)(=O)OC1=C(NC2=C1C=CC=C2)C3=C(OS(O)(=O)=O)C4=C(S3)C5=C(C=CC=C5Cl)C=C4

InChI

InChIKey=NRFUTWBVVHHZJI-UHFFFAOYSA-N
InChI=1S/C20H12ClNO8S3/c21-13-6-3-4-10-8-9-12-18(30-33(26,27)28)20(31-19(12)15(10)13)16-17(29-32(23,24)25)11-5-1-2-7-14(11)22-16/h1-9,22H,(H,23,24,25)(H,26,27,28)

HIDE SMILES / InChI

Approval Year

Name Type Language
1H-Indol-3-ol, 2-[9-chloro-3-(sulfooxy)naphtho[1,2-b]thien-2-yl]-, 3-(hydrogen sulfate)
Preferred Name English
2-[9-Chloro-3-(sulfooxy)naphtho[1,2-b]thien-2-yl]-1H-indol-3-yl hydrogen sulfate
Systematic Name English
Indol-3-ol, 2-(9-chloro-3-hydroxynaphtho[1,2-b]thien-2-yl)-, bis(hydrogen sulfate)
Systematic Name English
1H-Indol-3-ol, 2-[9-chloro-3-(sulfooxy)naphtho[1,2-b]thien-2-yl]-, hydrogen sulfate (ester)
Systematic Name English
Code System Code Type Description
PUBCHEM
82422
Created by admin on Wed Apr 02 19:21:45 GMT 2025 , Edited by admin on Wed Apr 02 19:21:45 GMT 2025
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CAS
6536-61-4
Created by admin on Wed Apr 02 19:21:45 GMT 2025 , Edited by admin on Wed Apr 02 19:21:45 GMT 2025
PRIMARY
FDA UNII
7A6PKV8E8L
Created by admin on Wed Apr 02 19:21:45 GMT 2025 , Edited by admin on Wed Apr 02 19:21:45 GMT 2025
PRIMARY