3-Benzylsydnone-4-acetamide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H11N3O3
Molecular Weight	233.2233
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-Benzylsydnone-4-acetamide

Structure Search

SMILES

NC(=O)CC1=C([O-])ON=[N+]1CC2=CC=CC=C2

InChI

InChIKey=GPEINOHASDVYFS-UHFFFAOYSA-N

InChI=1S/C11H11N3O3/c12-10(15)6-9-11(16)17-13-14(9)7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2-,12,13,15,16)

HIDE SMILES / InChI

Molecular Formula	C11H12N3O3
Molecular Weight	234.2313
Charge	1
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 08:36:52 GMT 2023` Edited by `admin` on `Sat Dec 16 08:36:52 GMT 2023`
Record UNII	KD7SW2CG9V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-Benzylsydnone-4-acetamide

Common Name

English

4-(2-Amino-2-oxoethyl)-3-benzyloxadiazol-3-ium-5-olate

Systematic Name

English

1,2,3-Oxadiazolium, 4-(2-amino-2-oxoethyl)-5-hydroxy-3-(phenylmethyl)-, inner salt

Systematic Name

English

Sydnone, 3-benzyl-4-(carbamoylmethyl)-

Common Name

English

Sydnone, 4-(2-amino-2-oxoethyl)-3-(phenylmethyl)-

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID5020158

Created by admin on Sat Dec 16 08:36:52 GMT 2023 , Edited by admin on Sat Dec 16 08:36:52 GMT 2023

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PUBCHEM

84482

Created by admin on Sat Dec 16 08:36:52 GMT 2023 , Edited by admin on Sat Dec 16 08:36:52 GMT 2023

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CAS

14504-15-5

Created by admin on Sat Dec 16 08:36:52 GMT 2023 , Edited by admin on Sat Dec 16 08:36:52 GMT 2023

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FDA UNII

KD7SW2CG9V

Created by admin on Sat Dec 16 08:36:52 GMT 2023 , Edited by admin on Sat Dec 16 08:36:52 GMT 2023

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