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Details

Stereochemistry ACHIRAL
Molecular Formula C17H21NO.H2O4S
Molecular Weight 353.433
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHENYLTOLOXAMINE BISULFATE

SMILES

OS(O)(=O)=O.CN(C)CCOC1=C(CC2=CC=CC=C2)C=CC=C1

InChI

InChIKey=VZOJBSZQSXEYMG-UHFFFAOYSA-N
InChI=1S/C17H21NO.H2O4S/c1-18(2)12-13-19-17-11-7-6-10-16(17)14-15-8-4-3-5-9-15;1-5(2,3)4/h3-11H,12-14H2,1-2H3;(H2,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula H2O4S
Molecular Weight 98.078
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C17H21NO
Molecular Weight 255.3547
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 Fri Dec 15 15:31:11 GMT 2023
Edited
by admin
on Fri Dec 15 15:31:11 GMT 2023
Record UNII
407TU1DJUP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PHENYLTOLOXAMINE BISULFATE
Common Name English
ETHYLAMINE, N,N-DIMETHYL-2-((.ALPHA.-PHENYL-O-TOLYL)OXY)-, SULFATE
Common Name English
PHENYLTOLOXAMINE HYDROGEN SULFATE
Common Name English
Code System Code Type Description
CAS
7056-17-9
Created by admin on Fri Dec 15 15:31:11 GMT 2023 , Edited by admin on Fri Dec 15 15:31:11 GMT 2023
PRIMARY
FDA UNII
407TU1DJUP
Created by admin on Fri Dec 15 15:31:11 GMT 2023 , Edited by admin on Fri Dec 15 15:31:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID40220846
Created by admin on Fri Dec 15 15:31:11 GMT 2023 , Edited by admin on Fri Dec 15 15:31:11 GMT 2023
PRIMARY
PUBCHEM
71586906
Created by admin on Fri Dec 15 15:31:11 GMT 2023 , Edited by admin on Fri Dec 15 15:31:11 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE