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Details

Stereochemistry RACEMIC
Molecular Formula C13H11NO
Molecular Weight 197.2325
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9,10-EPOXY-7,8,9,10-TETRAHYDROBENZO(H)QUINOLINE

SMILES

C1CC2=C([C@@H]3O[C@H]13)C4=NC=CC=C4C=C2

InChI

InChIKey=GQQULZUOSXVLJY-ZWNOBZJWSA-N
InChI=1S/C13H11NO/c1-2-9-4-3-8-5-6-10-13(15-10)11(8)12(9)14-7-1/h1-4,7,10,13H,5-6H2/t10-,13-/m1/s1

HIDE SMILES / InChI

Molecular Formula C13H11NO
Molecular Weight 197.2325
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 22:02:48 GMT 2025
Edited
by admin
on Mon Mar 31 22:02:48 GMT 2025
Record UNII
3VT396246L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OXIRENO(3,4)BENZO(1,2-H)QUINOLINE, 1A,8,9,9A-TETRAHYDRO-
Preferred Name English
9,10-EPOXY-7,8,9,10-TETRAHYDROBENZO(H)QUINOLINE
Systematic Name English
Code System Code Type Description
FDA UNII
3VT396246L
Created by admin on Mon Mar 31 22:02:48 GMT 2025 , Edited by admin on Mon Mar 31 22:02:48 GMT 2025
PRIMARY
PUBCHEM
121493493
Created by admin on Mon Mar 31 22:02:48 GMT 2025 , Edited by admin on Mon Mar 31 22:02:48 GMT 2025
PRIMARY
CAS
113163-24-9
Created by admin on Mon Mar 31 22:02:48 GMT 2025 , Edited by admin on Mon Mar 31 22:02:48 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
EPA CompTox
DTXSID60921005
Created by admin on Mon Mar 31 22:02:48 GMT 2025 , Edited by admin on Mon Mar 31 22:02:48 GMT 2025
PRIMARY