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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H17N3O3
Molecular Weight 275.3031
Optical Activity ( + )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-Oxo-6-(phenylmethoxy)-1,6-diazabicyclo[3.2.1]octane-2-carboxamide, (1S,2R,5S)-

SMILES

[H][C@@]12C[N@@]([C@H](CC1)C(N)=O)C(=O)N2OCC3=CC=CC=C3

InChI

InChIKey=HYTSWLKLRKLRHK-NWDGAFQWSA-N
InChI=1S/C14H17N3O3/c15-13(18)12-7-6-11-8-16(12)14(19)17(11)20-9-10-4-2-1-3-5-10/h1-5,11-12H,6-9H2,(H2,15,18)/t11-,12+/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H17N3O3
Molecular Weight 275.3031
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 20:22:07 GMT 2023
Edited
by admin
on Sat Dec 16 20:22:07 GMT 2023
Record UNII
AB5XBD54BV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-Oxo-6-(phenylmethoxy)-1,6-diazabicyclo[3.2.1]octane-2-carboxamide, (1S,2R,5S)-
Systematic Name English
(1S,2R,5S)-6-benzyloxy-7-oxo-1,6-diazabicyclo[3.2.1]octane-2-carboxamide
Systematic Name English
(2R,5S)-6-(Benzyloxy)-7-oxo-1,6-diazabicyclo[3.2.1]octane-2-carboxamide
Systematic Name English
1,6-Diazabicyclo[3.2.1]octane-2-carboxamide, 7-oxo-6-(phenylmethoxy)-, (1S,2R,5S)-
Systematic Name English
(1S,2R,5S)-7-Oxo-6-(phenylmethoxy)-1,6-diazabicyclo[3.2.1]octane-2-carboxamide
Systematic Name English
Code System Code Type Description
PUBCHEM
66870463
Created by admin on Sat Dec 16 20:22:07 GMT 2023 , Edited by admin on Sat Dec 16 20:22:07 GMT 2023
PRIMARY
CAS
1383814-72-9
Created by admin on Sat Dec 16 20:22:07 GMT 2023 , Edited by admin on Sat Dec 16 20:22:07 GMT 2023
PRIMARY
FDA UNII
AB5XBD54BV
Created by admin on Sat Dec 16 20:22:07 GMT 2023 , Edited by admin on Sat Dec 16 20:22:07 GMT 2023
PRIMARY