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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H17N3O5
Molecular Weight 319.3126
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (R)-2-(4-ETHYL-2,3-DIOXOPIPERAZINE-1-CARBOXAMIDO)-2-PHENYLACETIC ACID

SMILES

CCN1CCN(C(=O)N[C@@H](C(O)=O)C2=CC=CC=C2)C(=O)C1=O

InChI

InChIKey=JQEHQELQPPKXRR-LLVKDONJSA-N
InChI=1S/C15H17N3O5/c1-2-17-8-9-18(13(20)12(17)19)15(23)16-11(14(21)22)10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3,(H,16,23)(H,21,22)/t11-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H17N3O5
Molecular Weight 319.3126
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:26:21 UTC 2023
Edited
by admin
on Sat Dec 16 18:26:21 UTC 2023
Record UNII
YG582EF7NG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(R)-2-(4-ETHYL-2,3-DIOXOPIPERAZINE-1-CARBOXAMIDO)-2-PHENYLACETIC ACID
Common Name English
BENZENEACETIC ACID, .ALPHA.-(((4-ETHYL-2,3-DIOXO-1-PIPERAZINYL)CARBONYL)AMINO)-, (.ALPHA.R)-
Systematic Name English
PIPERACILLIN SODIUM IMPURITY G [EP IMPURITY]
Common Name English
(R)-(((4-ETHYL-2,3-DIOXOPIPERAZIN-1-YL)CARBONYL)AMINO)PHENYLACETICACID
Systematic Name English
BENZENEACETIC ACID, .ALPHA.-(((4-ETHYL-2,3-DIOXO-1-PIPERAZINYL)CARBONYL)AMINO)-, (R)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50212838
Created by admin on Sat Dec 16 18:26:21 UTC 2023 , Edited by admin on Sat Dec 16 18:26:21 UTC 2023
PRIMARY
ECHA (EC/EINECS)
264-133-8
Created by admin on Sat Dec 16 18:26:21 UTC 2023 , Edited by admin on Sat Dec 16 18:26:21 UTC 2023
PRIMARY
FDA UNII
YG582EF7NG
Created by admin on Sat Dec 16 18:26:21 UTC 2023 , Edited by admin on Sat Dec 16 18:26:21 UTC 2023
PRIMARY
CAS
63422-71-9
Created by admin on Sat Dec 16 18:26:21 UTC 2023 , Edited by admin on Sat Dec 16 18:26:21 UTC 2023
PRIMARY
PUBCHEM
2733658
Created by admin on Sat Dec 16 18:26:21 UTC 2023 , Edited by admin on Sat Dec 16 18:26:21 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP