ISONITROSOACETONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C3H5NO2
Molecular Weight	87.0773
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)\C=N\O

InChI

InChIKey=OVGLVOLWBBGQHS-DUXPYHPUSA-N

InChI=1S/C3H5NO2/c1-3(5)2-4-6/h2,6H,1H3/b4-2+

HIDE SMILES / InChI

Molecular Formula	C3H5NO2
Molecular Weight	87.0773
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Reactivation of brain acetylcholinesterase by monoisonitrosoacetone increases the therapeutic efficacy against nerve agents in guinea pigs.	2010 Sep 6	20230808
Reactivation of organophosphate-inhibited human acetylcholinesterase by isonitrosoacetone (MINA): a kinetic analysis.	2011 Nov 15	21930118
Mechanism of interaction of novel uncharged, centrally active reactivators with OP-hAChE conjugates.	2013 Mar 25	22975155
Centrally acting oximes in reactivation of tabun-phosphoramidated AChE.	2013 Mar 25	22960624

Substance Class	Chemical Created by `admin` on `Sat Dec 16 02:18:41 GMT 2023` Edited by `admin` on `Sat Dec 16 02:18:41 GMT 2023`
Record UNII	U32V8CLT4W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISONITROSOACETONE

Common Name

English

MONOISONITROSOACETONE

Common Name

English

PYRUVALDEHYDE, ALDOXIME

Common Name

English

PYRUVALDEHYDE, 1-OXIME, (E)-

Common Name

English

PYRUVALDOXIME

Systematic Name

English

PROPANONE 1-OXIME

Common Name

English

PROPANAL, 2-OXO-, 1-OXIME, (1E)-

Systematic Name

English

NSC-53172

Code

English

ISONITROSOACETONE [MI]

Common Name

English

METHYLGLYOXAL ALDOXIME

Systematic Name

English

2-OXOPROPANAL 1-OXIME

Systematic Name

English

PYRUVALDEHYDE, 1-OXIME

Common Name

English

2-PROPANONE, 1-(HYDROXYIMINO)-

Systematic Name

English

Code System Code Type Description

CAS

17280-41-0