Compound Identification
SMILES
CC(C)CN1C(N)=C(C(=O)COC(=O)C2=C(Cl)C=C(F)C=C2)C(=O)N(C)C1=O
InChIKey
InChIKey=PWENLAUIERHCCL-UHFFFAOYSA-N
Formula
C18H19ClFN3O5
Mass
411.81
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
2-halobenzoic acids and derivatives 4-halobenzoic acids and derivatives Aryl alkyl ketones Benzoyl derivatives Aminopyrimidines and derivatives Pyrimidones Chlorobenzenes Fluorobenzenes Aryl chlorides Aryl fluorides Hydropyrimidines Vinylogous halides Vinylogous amides Heteroaromatic compounds Carboxylic acid esters Ureas Lactams Amino acids and derivatives Azacyclic compounds Organic oxides Organochlorides Organofluorides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoate ester - Aryl ketone - Aryl alkyl ketone - Benzoyl - Halobenzene - Fluorobenzene - Pyrimidone - Chlorobenzene - Aminopyrimidine - Aryl chloride - Hydropyrimidine - Pyrimidine - Aryl fluoride - Aryl halide - Heteroaromatic compound - Vinylogous halide - Vinylogous amide - Amino acid or derivatives - Carboxylic acid ester - Urea - Ketone - Lactam - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organooxygen compound - Primary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - Organofluoride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available