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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 Isopropyl 4-nitrobenzoate

SMILES

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

InChI

InChIKey=JSZSPHFHMMXJEU-UHFFFAOYSA-N
InChI=1S/C10H11NO4/c1-7(2)15-10(12)8-3-5-9(6-4-8)11(13)14/h3-7H,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
Isopropyl 4-nitrobenzoate
Systematic Name English
NSC-50762
Preferred Name English
Benzoic acid, 4-nitro-, 1-methylethyl ester
Systematic Name English
4-Nitro-benzoic acid isopropyl ester
Common Name English
Isopropyl p-nitrobenzoate
Systematic Name English
1-Methylethyl 4-nitrobenzoate
Systematic Name English
Code System Code Type Description
FDA UNII
SF2LCB356V
Created by admin on Wed Apr 02 18:23:10 GMT 2025 , Edited by admin on Wed Apr 02 18:23:10 GMT 2025
PRIMARY
EPA CompTox
DTXSID70287381
Created by admin on Wed Apr 02 18:23:10 GMT 2025 , Edited by admin on Wed Apr 02 18:23:10 GMT 2025
PRIMARY
CAS
13756-40-6
Created by admin on Wed Apr 02 18:23:10 GMT 2025 , Edited by admin on Wed Apr 02 18:23:10 GMT 2025
PRIMARY
PUBCHEM
242282
Created by admin on Wed Apr 02 18:23:10 GMT 2025 , Edited by admin on Wed Apr 02 18:23:10 GMT 2025
PRIMARY