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Details

Stereochemistry ACHIRAL
Molecular Formula C13H16N4O4
Molecular Weight 292.2905
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-AMINO-6-(3,4,5-TRIMETHOXYBENZYL)-1,2,4-TRIAZIN-5-OL

SMILES

COC1=CC(CC2=C(O)N=C(N)N=N2)=CC(OC)=C1OC

InChI

InChIKey=XHMXYVPLPZCNGI-UHFFFAOYSA-N
InChI=1S/C13H16N4O4/c1-19-9-5-7(6-10(20-2)11(9)21-3)4-8-12(18)15-13(14)17-16-8/h5-6H,4H2,1-3H3,(H3,14,15,17,18)

HIDE SMILES / InChI

Molecular Formula C13H16N4O4
Molecular Weight 292.2905
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 12:54:24 GMT 2023
Edited
by admin
on Sat Dec 16 12:54:24 GMT 2023
Record UNII
XWL7U4C0GB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-AMINO-6-(3,4,5-TRIMETHOXYBENZYL)-1,2,4-TRIAZIN-5-OL
Systematic Name English
NSC-287102
Code English
1,2,4-TRIAZIN-5(2H)-ONE, 3-AMINO-6-((3,4,5-TRIMETHOXYPHENYL)METHYL)-
Systematic Name English
3-AMINO-6-((3,4,5-TRIMETHOXYPHENYL)METHYL)-1,2,4-TRIAZIN-5(2H)-ONE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID80210342
Created by admin on Sat Dec 16 12:54:24 GMT 2023 , Edited by admin on Sat Dec 16 12:54:24 GMT 2023
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FDA UNII
XWL7U4C0GB
Created by admin on Sat Dec 16 12:54:24 GMT 2023 , Edited by admin on Sat Dec 16 12:54:24 GMT 2023
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CAS
61404-59-9
Created by admin on Sat Dec 16 12:54:24 GMT 2023 , Edited by admin on Sat Dec 16 12:54:24 GMT 2023
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PUBCHEM
135406833
Created by admin on Sat Dec 16 12:54:24 GMT 2023 , Edited by admin on Sat Dec 16 12:54:24 GMT 2023
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NSC
287102
Created by admin on Sat Dec 16 12:54:24 GMT 2023 , Edited by admin on Sat Dec 16 12:54:24 GMT 2023
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