Compound Identification
SMILES
CC1=CC=C(C=C1)[S+](C1=CC=CC=C1)C1=C(C)C=CC(C)=C1.OC(=O)C(OC(=O)C1=CC=CC=C1)C(OC(=O)C1=CC=CC=C1)C([O-])=O
InChIKey
InChIKey=UPAYOWHZAHIRRV-UHFFFAOYSA-M
Formula
C39H34O8S
Mass
662.75
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
-
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
p-Xylenes Benzoyl derivatives Toluenes Monosaccharides Dicarboxylic acids and derivatives Carboxylic acid salts Carboxylic acid esters Carboxylic acids Organosulfur compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Not available
Substituents
Benzoate ester - Benzoyl - P-xylene - Xylene - Toluene - Dicarboxylic acid or derivatives - Monosaccharide - Carboxylic acid ester - Carboxylic acid salt - Carboxylic acid derivative - Carboxylic acid - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organosulfur compound - Organooxygen compound - Organic cation - Aromatic homomonocyclic 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