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Details

Stereochemistry ACHIRAL
Molecular Formula C18H20N4O2.2ClH
Molecular Weight 397.299
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NITRACRINE DIHYDROCHLORIDE

SMILES

Cl.Cl.CN(C)CCCNC1=C2C=CC=CC2=NC3=C1C(=CC=C3)[N+]([O-])=O

InChI

InChIKey=XBHIADYHFGJGSK-UHFFFAOYSA-N
InChI=1S/C18H20N4O2.2ClH/c1-21(2)12-6-11-19-18-13-7-3-4-8-14(13)20-15-9-5-10-16(17(15)18)22(23)24;;/h3-5,7-10H,6,11-12H2,1-2H3,(H,19,20);2*1H

HIDE SMILES / InChI

Molecular Formula C18H20N4O2
Molecular Weight 324.377
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:47:54 UTC 2023
Edited
by admin
on Sat Dec 16 10:47:54 UTC 2023
Record UNII
T450D0Q71D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NITRACRINE DIHYDROCHLORIDE
Common Name English
9-(3-((DIMETHYLAMINO)PROPYL)AMINO)-1-NITROACRIDINE DIHYDROCHLORIDE
Systematic Name English
1,3-PROPANEDIAMINE, N1,N1-DIMETHYL-N3-(1-NITRO-9-ACRIDINYL)-, HYDROCHLORIDE (1:2)
Systematic Name English
NSC-247561
Code English
Code System Code Type Description
NSC
247561
Created by admin on Sat Dec 16 10:47:54 UTC 2023 , Edited by admin on Sat Dec 16 10:47:54 UTC 2023
PRIMARY
PUBCHEM
23015
Created by admin on Sat Dec 16 10:47:54 UTC 2023 , Edited by admin on Sat Dec 16 10:47:54 UTC 2023
PRIMARY
FDA UNII
T450D0Q71D
Created by admin on Sat Dec 16 10:47:54 UTC 2023 , Edited by admin on Sat Dec 16 10:47:54 UTC 2023
PRIMARY
CAS
6514-85-8
Created by admin on Sat Dec 16 10:47:54 UTC 2023 , Edited by admin on Sat Dec 16 10:47:54 UTC 2023
PRIMARY
EPA CompTox
DTXSID60983709
Created by admin on Sat Dec 16 10:47:54 UTC 2023 , Edited by admin on Sat Dec 16 10:47:54 UTC 2023
PRIMARY
Related Record Type Details
SOLVATE->ANHYDROUS