U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C9H7NO
Molecular Weight 145.158
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5,6-EPOXY-5,6-DIHYDROQUINOLINE, (5S,6R)-

SMILES

O1[C@@H]2C=CC3=C(C=CC=N3)[C@H]12

InChI

InChIKey=DUTMSHWTRSUNIF-BDAKNGLRSA-N
InChI=1S/C9H7NO/c1-2-6-7(10-5-1)3-4-8-9(6)11-8/h1-5,8-9H/t8-,9+/m1/s1

HIDE SMILES / InChI

Molecular Formula C9H7NO
Molecular Weight 145.158
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 Sat Dec 16 11:31:09 GMT 2023
Edited
by admin
on Sat Dec 16 11:31:09 GMT 2023
Record UNII
2M7Q146S7V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5,6-EPOXY-5,6-DIHYDROQUINOLINE, (5S,6R)-
Systematic Name English
OXIRENO(F)QUINOLINE, 1A,7B-DIHYDRO-, (1AR)-
Systematic Name English
Code System Code Type Description
FDA UNII
2M7Q146S7V
Created by admin on Sat Dec 16 11:31:09 GMT 2023 , Edited by admin on Sat Dec 16 11:31:09 GMT 2023
PRIMARY
CAS
135096-21-8
Created by admin on Sat Dec 16 11:31:09 GMT 2023 , Edited by admin on Sat Dec 16 11:31:09 GMT 2023
PRIMARY
PUBCHEM
13706520
Created by admin on Sat Dec 16 11:31:09 GMT 2023 , Edited by admin on Sat Dec 16 11:31:09 GMT 2023
PRIMARY