Compound Identification
SMILES
NC1=CC=C(Cl)C=C1.CC(=C)COCCCCCOC1=CC=C(C=C1)C(O)=O
InChIKey
InChIKey=RMJYSFOYAQVOOT-UHFFFAOYSA-N
Formula
C22H28ClNO4
Mass
405.92
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acids
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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 acids
Alternative Parents
Phenoxy compounds Phenol ethers Benzoyl derivatives Aniline and substituted anilines Chlorobenzenes Alkyl aryl ethers Aryl chlorides Dialkyl ethers Carboxylic acids Primary amines Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Benzoic acid - Phenoxy compound - Benzoyl - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Organic oxide - Amine - Primary amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organohalogen compound - Organochloride - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acids. These are organic Compounds containing a benzene ring which bears at least one carboxyl group.
External Descriptors
Not available