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Details

Stereochemistry RACEMIC
Molecular Formula C16H22Cl2N2O.ClH
Molecular Weight 365.726
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of U-47700 hydrochloride

SMILES

Cl.CN(C)[C@H]1CCCC[C@@H]1N(C)C(=O)C2=CC(Cl)=C(Cl)C=C2

InChI

InChIKey=PPYIOFRTHARFMC-YYLIZZNMSA-N
InChI=1S/C16H22Cl2N2O.ClH/c1-19(2)14-6-4-5-7-15(14)20(3)16(21)11-8-9-12(17)13(18)10-11;/h8-10,14-15H,4-7H2,1-3H3;1H/t14-,15-;/m0./s1

HIDE SMILES / InChI

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

Molecular Formula C16H22Cl2N2O
Molecular Weight 329.265
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 20:18:25 GMT 2025
Edited
by admin
on Wed Apr 02 20:18:25 GMT 2025
Record UNII
AGQ8AUH62H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
U-47700 hydrochloride
Common Name English
trans-3,4-Dichloro-N-[2-(dimethylamino)cyclohexyl]-N-methyl-benzamide monohydrochloride
Preferred Name English
Code System Code Type Description
FDA UNII
AGQ8AUH62H
Created by admin on Wed Apr 02 20:18:25 GMT 2025 , Edited by admin on Wed Apr 02 20:18:25 GMT 2025
PRIMARY
CAYMAN
21078
Created by admin on Wed Apr 02 20:18:25 GMT 2025 , Edited by admin on Wed Apr 02 20:18:25 GMT 2025
PRIMARY
PUBCHEM
131632192
Created by admin on Wed Apr 02 20:18:25 GMT 2025 , Edited by admin on Wed Apr 02 20:18:25 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE