5-NITRO-2-(2-NITROPHENYL)-1H-BENZIMIDAZOLE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H8N4O4
Molecular Weight	284.227
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-NITRO-2-(2-NITROPHENYL)-1H-BENZIMIDAZOLE

Structure Search

SMILES

[O-][N+](=O)C1=CC=C2NC(=NC2=C1)C3=C(C=CC=C3)[N+]([O-])=O

InChI

InChIKey=LUPBTDLFUOLFAC-UHFFFAOYSA-N

InChI=1S/C13H8N4O4/c18-16(19)8-5-6-10-11(7-8)15-13(14-10)9-3-1-2-4-12(9)17(20)21/h1-7H,(H,14,15)

HIDE SMILES / InChI

Molecular Formula	C13H8N4O4
Molecular Weight	284.227
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 12:49:23 GMT 2023` Edited by `admin` on `Sat Dec 16 12:49:23 GMT 2023`
Record UNII	A9ZE5UZ5VU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-NITRO-2-(2-NITROPHENYL)-1H-BENZIMIDAZOLE

Systematic Name

English

5-(HYDROXY(OXIDO)AMINO)-2-(2-(HYDROXY(OXIDO)AMINO)PHENYL)-1H-BENZIMIDAZOLE

Systematic Name

English

NSC-128740

Code

English

Code System Code Type Description

CAS

5805-47-0

Created by admin on Sat Dec 16 12:49:23 GMT 2023 , Edited by admin on Sat Dec 16 12:49:23 GMT 2023

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EPA CompTox

DTXSID90206776

Created by admin on Sat Dec 16 12:49:23 GMT 2023 , Edited by admin on Sat Dec 16 12:49:23 GMT 2023

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NSC

128740

Created by admin on Sat Dec 16 12:49:23 GMT 2023 , Edited by admin on Sat Dec 16 12:49:23 GMT 2023

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PUBCHEM

278810

Created by admin on Sat Dec 16 12:49:23 GMT 2023 , Edited by admin on Sat Dec 16 12:49:23 GMT 2023

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FDA UNII

A9ZE5UZ5VU

Created by admin on Sat Dec 16 12:49:23 GMT 2023 , Edited by admin on Sat Dec 16 12:49:23 GMT 2023

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