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Details

Stereochemistry ACHIRAL
Molecular Formula C11H12N2O6
Molecular Weight 268.2228
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 4-ACETAMIDO-2-METHOXY-5-NITROBENZOATE

SMILES

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

InChI

InChIKey=AGSSDWHUSPSVFS-UHFFFAOYSA-N
InChI=1S/C11H12N2O6/c1-6(14)12-8-5-10(18-2)7(11(15)19-3)4-9(8)13(16)17/h4-5H,1-3H3,(H,12,14)

HIDE SMILES / InChI

Molecular Formula C11H12N2O6
Molecular Weight 268.2228
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 18:53:18 GMT 2025
Edited
by admin
on Tue Apr 01 18:53:18 GMT 2025
Record UNII
VZ94Q2BM73
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL 4-(ACETYLAMINO)-5-NITRO-O-ANISATE
Preferred Name English
METHYL 4-ACETAMIDO-2-METHOXY-5-NITROBENZOATE
Common Name English
BENZOIC ACID, 4-(ACETYLAMINO)-2-METHOXY-5-NITRO-, METHYL ESTER
Systematic Name English
4-ACETYLAMINO-2-METHOXY-5-NITROBENZOIC ACID METHYL ESTER
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
223-844-3
Created by admin on Tue Apr 01 18:53:18 GMT 2025 , Edited by admin on Tue Apr 01 18:53:18 GMT 2025
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FDA UNII
VZ94Q2BM73
Created by admin on Tue Apr 01 18:53:18 GMT 2025 , Edited by admin on Tue Apr 01 18:53:18 GMT 2025
PRIMARY
EPA CompTox
DTXSID10193937
Created by admin on Tue Apr 01 18:53:18 GMT 2025 , Edited by admin on Tue Apr 01 18:53:18 GMT 2025
PRIMARY
PUBCHEM
77723
Created by admin on Tue Apr 01 18:53:18 GMT 2025 , Edited by admin on Tue Apr 01 18:53:18 GMT 2025
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CAS
4093-41-8
Created by admin on Tue Apr 01 18:53:18 GMT 2025 , Edited by admin on Tue Apr 01 18:53:18 GMT 2025
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