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Details

Stereochemistry RACEMIC
Molecular Formula C14H11NO4
Molecular Weight 257.2414
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2-Dihydro-10-nitro-1,2-anthracenediol, (1R,2R)-rel-

SMILES

O[C@H]1C=CC2=C(C=C3C=CC=CC3=C2[N+]([O-])=O)[C@@H]1O

InChI

InChIKey=VNOVNHOBHYKYND-JSGCOSHPSA-N
InChI=1S/C14H11NO4/c16-12-6-5-10-11(14(12)17)7-8-3-1-2-4-9(8)13(10)15(18)19/h1-7,12,14,16-17H/t12-,14-/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H11NO4
Molecular Weight 257.2414
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:53:00 GMT 2025
Edited
by admin
on Mon Mar 31 21:53:00 GMT 2025
Record UNII
N8QZ9VCZ43
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2-Anthracenediol, 1,2-dihydro-10-nitro-, (1R,2R)-rel-
Preferred Name English
1,2-Dihydro-10-nitro-1,2-anthracenediol, (1R,2R)-rel-
Systematic Name English
rel-(1R,2R)-1,2-Dihydro-10-nitro-1,2-anthracenediol
Systematic Name English
1,2-Anthracenediol, 1,2-dihydro-10-nitro-, trans-
Systematic Name English
Code System Code Type Description
PUBCHEM
23623219
Created by admin on Mon Mar 31 21:53:00 GMT 2025 , Edited by admin on Mon Mar 31 21:53:00 GMT 2025
PRIMARY
CAS
97509-27-8
Created by admin on Mon Mar 31 21:53:00 GMT 2025 , Edited by admin on Mon Mar 31 21:53:00 GMT 2025
PRIMARY
FDA UNII
N8QZ9VCZ43
Created by admin on Mon Mar 31 21:53:00 GMT 2025 , Edited by admin on Mon Mar 31 21:53:00 GMT 2025
PRIMARY
EPA CompTox
DTXSID60913889
Created by admin on Mon Mar 31 21:53:00 GMT 2025 , Edited by admin on Mon Mar 31 21:53:00 GMT 2025
PRIMARY