Compound Identification
SMILES
CN(C)C1=C(C)C(=O)C(COC(=O)C2=CC(OCC3=CC=CO3)=C(C=C2)N(CCCl)CCCl)=C(C)C1=O
InChIKey
InChIKey=FSAVVMRBXYQAPG-UHFFFAOYSA-N
Formula
C27H30Cl2N2O6
Mass
549.45
Taxonomic Classification
Taxonomy Tree
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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
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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
Aminobenzoic acids and derivatives Aminophenyl ethers Phenoxy compounds P-benzoquinones Aniline and substituted anilines Benzoyl derivatives Nitrogen mustard compounds Dialkylarylamines Alkyl aryl ethers Vinylogous amides Furans Heteroaromatic compounds Carboxylic acid esters Trialkylamines Amino acids and derivatives Oxacyclic compounds Enamines Hydrocarbon derivatives Organic oxides Organochlorides Alkyl chlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - Aminobenzoic acid or derivatives - Aminophenyl ether - Nitrogen mustard - P-benzoquinone - Phenol ether - Quinone - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Benzoyl - Phenoxy compound - Alkyl aryl ether - Vinylogous amide - Furan - Heteroaromatic compound - Cyclic ketone - Carboxylic acid ester - Ketone - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Enamine - Ether - Amine - Alkyl halide - Alkyl chloride - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organochloride - 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