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Details

Stereochemistry ACHIRAL
Molecular Formula C8H9N5O3.ClH
Molecular Weight 259.65
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NITROGUANIL

SMILES

Cl.NC(=N)NC(=O)NC1=CC=C(C=C1)[N+]([O-])=O

InChI

InChIKey=DPAWTAYKXUVQSN-UHFFFAOYSA-N
InChI=1S/C8H9N5O3.ClH/c9-7(10)12-8(14)11-5-1-3-6(4-2-5)13(15)16;/h1-4H,(H5,9,10,11,12,14);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 C8H9N5O3
Molecular Weight 223.1888
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 15:09:27 GMT 2023
Edited
by admin
on Fri Dec 15 15:09:27 GMT 2023
Record UNII
PRJ0MY312P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NITROGUANIL
Common Name English
UREA, N-(AMINOIMINOMETHYL)-N'-(4-NITROPHENYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
UREA, 1-AMIDINO-3-(P-NITROPHENYL)-, HYDROCHLORIDE
Common Name English
UREA, N-(AMINOIMINOMETHYL)-N'-(4-NITROPHENYL)-, MONOHYDROCHLORIDE
Common Name English
NSC-56866
Code English
T-72
Code English
UREA, 1-AMIDINO-3-(P-NITROPHENYL)-, MONOHYDROCHLORIDE
Common Name English
3-(P-NITROPHENYL)-1-AMIDINOUREA HYDROCHLORIDE
Common Name English
Code System Code Type Description
FDA UNII
PRJ0MY312P
Created by admin on Fri Dec 15 15:09:27 GMT 2023 , Edited by admin on Fri Dec 15 15:09:27 GMT 2023
PRIMARY
PUBCHEM
5822
Created by admin on Fri Dec 15 15:09:27 GMT 2023 , Edited by admin on Fri Dec 15 15:09:27 GMT 2023
PRIMARY
EPA CompTox
DTXSID701018910
Created by admin on Fri Dec 15 15:09:27 GMT 2023 , Edited by admin on Fri Dec 15 15:09:27 GMT 2023
PRIMARY
CAS
51-58-1
Created by admin on Fri Dec 15 15:09:27 GMT 2023 , Edited by admin on Fri Dec 15 15:09:27 GMT 2023
PRIMARY
NSC
56866
Created by admin on Fri Dec 15 15:09:27 GMT 2023 , Edited by admin on Fri Dec 15 15:09:27 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE