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Details

Stereochemistry ACHIRAL
Molecular Formula C10H11NO4
Molecular Weight 209.1986
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl 4-methyl-3-nitrobenzoate

SMILES

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

InChI

InChIKey=FWOACYVHDUBZDT-UHFFFAOYSA-N
InChI=1S/C10H11NO4/c1-3-15-10(12)8-5-4-7(2)9(6-8)11(13)14/h4-6H,3H2,1-2H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
Ethyl 4-methyl-3-nitrobenzoate
Systematic Name English
Benzoic acid, 4-methyl-3-nitro-, ethyl ester
Systematic Name English
p-Toluic acid, 3-nitro-, ethyl ester
Systematic Name English
4-Methyl-3-nitrobenzoic acid ethyl ester
Systematic Name English
Code System Code Type Description
CAS
19013-15-1
Created by admin on Sat Dec 16 20:20:47 GMT 2023 , Edited by admin on Sat Dec 16 20:20:47 GMT 2023
PRIMARY
FDA UNII
CB2G5DT7XK
Created by admin on Sat Dec 16 20:20:47 GMT 2023 , Edited by admin on Sat Dec 16 20:20:47 GMT 2023
PRIMARY
PUBCHEM
14945864
Created by admin on Sat Dec 16 20:20:47 GMT 2023 , Edited by admin on Sat Dec 16 20:20:47 GMT 2023
PRIMARY
NIH
NCATS
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