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Details

Stereochemistry ACHIRAL
Molecular Formula C18H19N3O.2ClH
Molecular Weight 366.285
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of XR-5000 dIhydrochloride

SMILES

Cl.Cl.CN(C)CCNC(=O)C1=CC=CC2=CC3=CC=CC=C3N=C12

InChI

InChIKey=WFAUJCPSRLMTBB-UHFFFAOYSA-N
InChI=1S/C18H19N3O.2ClH/c1-21(2)11-10-19-18(22)15-8-5-7-14-12-13-6-3-4-9-16(13)20-17(14)15;;/h3-9,12H,10-11H2,1-2H3,(H,19,22);2*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 C18H19N3O
Molecular Weight 293.363
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 Sat Dec 16 08:38:05 UTC 2023
Edited
by admin
on Sat Dec 16 08:38:05 UTC 2023
Record UNII
748C75726M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
XR-5000 dIhydrochloride
Code English
CCRIS 4545
Common Name English
4-Acridinecarboxamide, N-[2-(dimethylamino)ethyl]-, hydrochloride (1:2)
Systematic Name English
Code System Code Type Description
PUBCHEM
150766
Created by admin on Sat Dec 16 08:38:05 UTC 2023 , Edited by admin on Sat Dec 16 08:38:05 UTC 2023
PRIMARY
EPA CompTox
DTXSID20237730
Created by admin on Sat Dec 16 08:38:05 UTC 2023 , Edited by admin on Sat Dec 16 08:38:05 UTC 2023
PRIMARY
CAS
89458-99-1
Created by admin on Sat Dec 16 08:38:05 UTC 2023 , Edited by admin on Sat Dec 16 08:38:05 UTC 2023
PRIMARY
FDA UNII
748C75726M
Created by admin on Sat Dec 16 08:38:05 UTC 2023 , Edited by admin on Sat Dec 16 08:38:05 UTC 2023
PRIMARY
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