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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H25NO2.ClH
Molecular Weight 347.879
Optical Activity ( - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Amino-5-(biphenyl-4-yl)-2-methylpentanoic acid ethyl ester hydrochloride, (2R,4S)-

SMILES

Cl.CCOC(=O)[C@H](C)C[C@H](N)CC1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChIKey=MYJTZLYRAWUSLB-WSCVZUBPSA-N
InChI=1S/C20H25NO2.ClH/c1-3-23-20(22)15(2)13-19(21)14-16-9-11-18(12-10-16)17-7-5-4-6-8-17;/h4-12,15,19H,3,13-14,21H2,1-2H3;1H/t15-,19+;/m1./s1

HIDE SMILES / InChI

Molecular Formula C20H25NO2
Molecular Weight 311.418
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 13:37:57 GMT 2025
Edited
by admin
on Wed Apr 02 13:37:57 GMT 2025
Record UNII
2CGP595S2W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2R,4S)-4-Amino-5-(biphenyl-4-yl)-2-methylpentanoic acid ethyl ester hydrochloride
Preferred Name English
4-Amino-5-(biphenyl-4-yl)-2-methylpentanoic acid ethyl ester hydrochloride, (2R,4S)-
Systematic Name English
[1,1?-Biphenyl]-4-pentanoic acid, ?-amino-?-methyl-, ethyl ester, hydrochloride, (?R,?S)-
Systematic Name English
(2R,4S)-Ethyl-5-([1,1?-biphenyl]-4-yl)-4-amino-2-methylpentanoate hydrochloride
Systematic Name English
Code System Code Type Description
CAS
149690-12-0
Created by admin on Wed Apr 02 13:37:57 GMT 2025 , Edited by admin on Wed Apr 02 13:37:57 GMT 2025
PRIMARY
FDA UNII
2CGP595S2W
Created by admin on Wed Apr 02 13:37:57 GMT 2025 , Edited by admin on Wed Apr 02 13:37:57 GMT 2025
PRIMARY
PUBCHEM
25017086
Created by admin on Wed Apr 02 13:37:57 GMT 2025 , Edited by admin on Wed Apr 02 13:37:57 GMT 2025
PRIMARY
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