Isonicotinamide oxide

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H6N2O2
Molecular Weight	138.124
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Isonicotinamide oxide

Structure Search

SMILES

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

InChI

InChIKey=NZUWTGHVOISMHN-UHFFFAOYSA-N

InChI=1S/C6H6N2O2/c7-6(9)5-1-3-8(10)4-2-5/h1-4H,(H2,7,9)

HIDE SMILES / InChI

Molecular Formula	C6H6N2O2
Molecular Weight	138.124
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 18:43:29 GMT 2025` Edited by `admin` on `Tue Apr 01 18:43:29 GMT 2025`
Record UNII	XF3ASU7ZUB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Isonicotinamide oxide

Common Name

English

NSC-18386

Preferred Name

English

4-Pyridinecarboxamide, 1-oxide

Systematic Name

English

1-Oxidopyridin-1-ium-4-carboxamide

Systematic Name

English

Isonicotinamide 1-oxide

Systematic Name

English

Code System Code Type Description

NSC

18386

Created by admin on Tue Apr 01 18:43:29 GMT 2025 , Edited by admin on Tue Apr 01 18:43:29 GMT 2025

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ECHA (EC/EINECS)

253-998-7

Created by admin on Tue Apr 01 18:43:29 GMT 2025 , Edited by admin on Tue Apr 01 18:43:29 GMT 2025

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EPA CompTox

DTXSID00191881

Created by admin on Tue Apr 01 18:43:29 GMT 2025 , Edited by admin on Tue Apr 01 18:43:29 GMT 2025

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PUBCHEM

72966

Created by admin on Tue Apr 01 18:43:29 GMT 2025 , Edited by admin on Tue Apr 01 18:43:29 GMT 2025

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FDA UNII

XF3ASU7ZUB

Created by admin on Tue Apr 01 18:43:29 GMT 2025 , Edited by admin on Tue Apr 01 18:43:29 GMT 2025

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CAS

38557-82-3

Created by admin on Tue Apr 01 18:43:29 GMT 2025 , Edited by admin on Tue Apr 01 18:43:29 GMT 2025

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