Compound Identification
SMILES
CCOC(=O)C1=CC=C(C=C1)N=C1SC(CC(=O)NC2=CC=C(F)C=C2)C(=O)N1CC1=CC(OC)=C(OC)C=C1
InChIKey
InChIKey=JVBQWBCQUCKQMF-UHFFFAOYSA-N
Formula
C29H28FN3O6S
Mass
565.62
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
Dimethoxybenzenes Anilides Phenoxy compounds Anisoles N-arylamides Benzoyl derivatives Alkyl aryl ethers Fluorobenzenes Aryl fluorides Thiazolidines Secondary carboxylic acid amides Isothioureas Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - O-dimethoxybenzene - Dimethoxybenzene - Anilide - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Phenol ether - N-arylamide - Alkyl aryl ether - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Thiazolidine - Secondary carboxylic acid amide - Carboxamide group - Isothiourea - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Ether - Organic oxide - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - 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