3-nitro-3H-1,5-benzodiazepine

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H7N3O2
Molecular Weight	189.1708
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-nitro-3H-1,5-benzodiazepine

Structure Search

SMILES

[O-][N+](=O)C1C=NC2=C(C=CC=C2)N=C1

InChI

InChIKey=SGIGOTZNQITOJU-UHFFFAOYSA-N

InChI=1S/C9H7N3O2/c13-12(14)7-5-10-8-3-1-2-4-9(8)11-6-7/h1-7H

HIDE SMILES / InChI

Molecular Formula	C9H7N3O2
Molecular Weight	189.1708
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 `Tue Apr 01 19:59:17 GMT 2025` Edited by `admin` on `Tue Apr 01 19:59:17 GMT 2025`
Record UNII	CHC2G2ZD56
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-89283

Preferred Name

English

3-nitro-3H-1,5-benzodiazepine

Systematic Name

English

3-(Hydroxy(oxido)amino)-3H-1,5-benzodiazepine

Systematic Name

English

3H-1,5-Benzodiazepine, 3-nitro-

Systematic Name

English

Code System Code Type Description

NSC

89283

Created by admin on Tue Apr 01 19:59:17 GMT 2025 , Edited by admin on Tue Apr 01 19:59:17 GMT 2025

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FDA UNII

CHC2G2ZD56

Created by admin on Tue Apr 01 19:59:17 GMT 2025 , Edited by admin on Tue Apr 01 19:59:17 GMT 2025

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CAS

65466-29-7

Created by admin on Tue Apr 01 19:59:17 GMT 2025 , Edited by admin on Tue Apr 01 19:59:17 GMT 2025

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PUBCHEM

259378

Created by admin on Tue Apr 01 19:59:17 GMT 2025 , Edited by admin on Tue Apr 01 19:59:17 GMT 2025

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EPA CompTox

DTXSID50215788

Created by admin on Tue Apr 01 19:59:17 GMT 2025 , Edited by admin on Tue Apr 01 19:59:17 GMT 2025

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