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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H22N2O2
Molecular Weight 322.4009
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL N-((2'-CYANO(1,1'-BIPHENYL)-4-YL)METHYL)-L-VALINATE

SMILES

COC(=O)[C@@H](NCC1=CC=C(C=C1)C2=CC=CC=C2C#N)C(C)C

InChI

InChIKey=ZQHINOUCNQKQEV-IBGZPJMESA-N
InChI=1S/C20H22N2O2/c1-14(2)19(20(23)24-3)22-13-15-8-10-16(11-9-15)18-7-5-4-6-17(18)12-21/h4-11,14,19,22H,13H2,1-3H3/t19-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H22N2O2
Molecular Weight 322.4009
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 09:47:43 UTC 2023
Edited
by admin
on Sat Dec 16 09:47:43 UTC 2023
Record UNII
13EG6HX8ND
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL N-((2'-CYANO(1,1'-BIPHENYL)-4-YL)METHYL)-L-VALINATE
Systematic Name English
L-VALINE, N-((2'-CYANO(1,1'-BIPHENYL)-4-YL)METHYL)-, METHYL ESTER
Systematic Name English
VALSARTAN IMPURITY D
Common Name English
N-((2'-CYANO(1,1'-BIPHENYL)-4-YL)METHYL)-L-VALINE METHYL ESTER
Systematic Name English
Code System Code Type Description
CAS
137863-89-9
Created by admin on Sat Dec 16 09:47:43 UTC 2023 , Edited by admin on Sat Dec 16 09:47:43 UTC 2023
PRIMARY
EPA CompTox
DTXSID50587775
Created by admin on Sat Dec 16 09:47:43 UTC 2023 , Edited by admin on Sat Dec 16 09:47:43 UTC 2023
PRIMARY
PUBCHEM
16744794
Created by admin on Sat Dec 16 09:47:43 UTC 2023 , Edited by admin on Sat Dec 16 09:47:43 UTC 2023
PRIMARY
FDA UNII
13EG6HX8ND
Created by admin on Sat Dec 16 09:47:43 UTC 2023 , Edited by admin on Sat Dec 16 09:47:43 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
PARENT -> IMPURITY