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Details

Stereochemistry RACEMIC
Molecular Formula C11H11Cl2NO3.ClH
Molecular Weight 312.577
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PNU-157678

SMILES

Cl.COC(=O)C(N)CC(=O)C1=CC=C(Cl)C(Cl)=C1

InChI

InChIKey=HSOIWCULNXJLEI-UHFFFAOYSA-N
InChI=1S/C11H11Cl2NO3.ClH/c1-17-11(16)9(14)5-10(15)6-2-3-7(12)8(13)4-6;/h2-4,9H,5,14H2,1H3;1H

HIDE SMILES / InChI

Approval Year

Name Type Language
BENZENEBUTANOIC ACID, .ALPHA.-AMINO-3,4-DICHLORO-.GAMMA.-OXO-, METHYL ESTER, HYDROCHLORIDE
Preferred Name English
PNU-157678
Code English
PNU157678
Code English
BENZENEBUTANOIC ACID, .ALPHA.-AMINO-3,4-DICHLORO-.GAMMA.-OXO-, METHYL ESTER, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
9948694
Created by admin on Mon Mar 31 21:42:02 GMT 2025 , Edited by admin on Mon Mar 31 21:42:02 GMT 2025
PRIMARY
FDA UNII
TM84M5L4V2
Created by admin on Mon Mar 31 21:42:02 GMT 2025 , Edited by admin on Mon Mar 31 21:42:02 GMT 2025
PRIMARY
CAS
202847-32-3
Created by admin on Mon Mar 31 21:42:02 GMT 2025 , Edited by admin on Mon Mar 31 21:42:02 GMT 2025
PRIMARY