Compound Identification
SMILES
CC1=CCC(C(C1)C1=CC=C(Br)C=C1)(C(O)=O)C(=O)NNC=C1C(=O)OC(C)(C)OC1=O
InChIKey
InChIKey=XIAZBIKCPQZTOW-UHFFFAOYSA-N
Formula
C22H23BrN2O7
Mass
507.337
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Tricarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Tricarboxylic acids and derivatives
Alternative Parents
Bromobenzenes Ketals 1,3-dioxanes Aryl bromides Vinylogous amides Enoate esters Carboxylic acid hydrazides Lactones Carboxylic acids Oxacyclic compounds Hydrocarbon derivatives Organobromides Carbonyl compounds Organonitrogen compounds Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Tricarboxylic acid or derivatives - Halobenzene - Bromobenzene - Ketal - Meta-dioxane - Aryl bromide - Benzenoid - Monocyclic benzene moiety - Aryl halide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Vinylogous amide - Lactone - Carboxylic acid hydrazide - Carboxylic acid ester - Carboxylic acid - Acetal - Organoheterocyclic compound - Oxacycle - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as tricarboxylic acids and derivatives. These are carboxylic acids containing exactly three carboxyl groups.
External Descriptors
Not available