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Details

Stereochemistry RACEMIC
Molecular Formula C20H25NO2.ClH
Molecular Weight 347.879
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZOBUTAMINE HYDROCHLORIDE

SMILES

Cl.CCC(COC(=O)C1=CC=CC=C1)(CN(C)C)C2=CC=CC=C2

InChI

InChIKey=YSLHBJFVGQSUAV-UHFFFAOYSA-N
InChI=1S/C20H25NO2.ClH/c1-4-20(15-21(2)3,18-13-9-6-10-14-18)16-23-19(22)17-11-7-5-8-12-17;/h5-14H,4,15-16H2,1-3H3;1H

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 C20H25NO2
Molecular Weight 311.418
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:15:01 GMT 2023
Edited
by admin
on Sat Dec 16 10:15:01 GMT 2023
Record UNII
XDP67V216G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZOBUTAMINE HYDROCHLORIDE
Common Name English
PHENETHYL ALCOHOL, .BETA.-(DIMETHYLAMINOMETHYL)-.BETA.-ETHYL-, BENZOATE, HYDROCHLORIDE
Systematic Name English
BENZENEETHANOL, .BETA.-((DIMETHYLAMINO)METHYL)-.BETA.-ETHYL-, 1-BENZOATE, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
CAS
64082-37-7
Created by admin on Sat Dec 16 10:15:01 GMT 2023 , Edited by admin on Sat Dec 16 10:15:01 GMT 2023
PRIMARY
FDA UNII
XDP67V216G
Created by admin on Sat Dec 16 10:15:01 GMT 2023 , Edited by admin on Sat Dec 16 10:15:01 GMT 2023
PRIMARY
PUBCHEM
24841279
Created by admin on Sat Dec 16 10:15:01 GMT 2023 , Edited by admin on Sat Dec 16 10:15:01 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE