Diethyl 2-(2-nitrobenzyl)malonate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H17NO6
Molecular Weight	295.2879
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Diethyl 2-(2-nitrobenzyl)malonate

Structure Search

SMILES

CCOC(=O)C(CC1=C(C=CC=C1)[N+]([O-])=O)C(=O)OCC

InChI

InChIKey=XKWHIUXRQYXRSG-UHFFFAOYSA-N

InChI=1S/C14H17NO6/c1-3-20-13(16)11(14(17)21-4-2)9-10-7-5-6-8-12(10)15(18)19/h5-8,11H,3-4,9H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name

Type

Language

Diethyl 2-(2-nitrobenzyl)malonate

Systematic Name

English

NSC-211482

Code

English

Diethyl o-nitrobenzylmalonate

Systematic Name

English

Propanedioic acid, [(2-nitrophenyl)methyl]-, diethyl ester

Systematic Name

English

Propanedioic acid, 2-[(2-nitrophenyl)methyl]-, 1,3-diethyl ester

Systematic Name

English

Diethyl 2-(2-(hydroxy(oxido)amino)benzyl)malonate

Systematic Name

English

1,3-Diethyl 2-[(2-nitrophenyl)methyl]propanedioate

Systematic Name

English

Code System Code Type Description

CAS

59803-35-9

Created by admin on Sat Dec 16 13:00:18 GMT 2023 , Edited by admin on Sat Dec 16 13:00:18 GMT 2023

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EPA CompTox

DTXSID40208543

Created by admin on Sat Dec 16 13:00:18 GMT 2023 , Edited by admin on Sat Dec 16 13:00:18 GMT 2023

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PUBCHEM

309274

Created by admin on Sat Dec 16 13:00:18 GMT 2023 , Edited by admin on Sat Dec 16 13:00:18 GMT 2023

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FDA UNII

LAU4ZRJ39E

Created by admin on Sat Dec 16 13:00:18 GMT 2023 , Edited by admin on Sat Dec 16 13:00:18 GMT 2023

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NSC

211482

Created by admin on Sat Dec 16 13:00:18 GMT 2023 , Edited by admin on Sat Dec 16 13:00:18 GMT 2023

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SUBSTANCE RECORD


					LAU4ZRJ39E

Diethyl 2-(2-nitrobenzyl)malonate