Compound Identification
SMILES
CCOC(=O)C1=C(OCC)C=C(CCNC(=O)C2=C(C=CC(Cl)=C2)N2CCCCCCCC2)C=C1
InChIKey
InChIKey=JOTLJJWLIQKGST-UHFFFAOYSA-N
Formula
C28H37ClN2O4
Mass
501.06
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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-aminobenzamides 3-halobenzoic acids and derivatives Anthranilamides Phenoxy compounds Phenol ethers Aniline and substituted anilines Dialkylarylamines Benzoyl derivatives Alkyl aryl ethers Chlorobenzenes Aryl chlorides Vinylogous amides Secondary carboxylic acid amides Amino acids and derivatives Carboxylic acid esters Azacyclic compounds Organochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - Anthranilamide - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Aminobenzamide - Aminobenzoic acid or derivatives - 2-aminobenzamide - Benzamide - Aniline or substituted anilines - Dialkylarylamine - Phenoxy compound - Tertiary aliphatic/aromatic amine - Benzoyl - Phenol ether - Halobenzene - Chlorobenzene - Alkyl aryl ether - Aryl halide - Aryl chloride - Vinylogous amide - Secondary carboxylic acid amide - Carboxamide group - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organohalogen compound - Organic oxygen compound - Organic oxide - 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