Compound Identification
SMILES
CCC1(C(COCCNC(=O)OC\C=C/COC(=O)OC(C)O[N+]([O-])=O)NC(C)=C(C1C1=CC=CC=C1Cl)C(=O)OC)C([O-])=O
InChIKey
InChIKey=CTTNCDHDJQHDPN-HJWRWDBZSA-M
Formula
C28H35ClN3O13
Mass
657.05
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Chlorobenzenes
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Subclass
Halobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Chlorobenzenes
Alternative Parents
Tetrahydropyridines Aralkylamines Aryl chlorides Carbonic acid diesters Dicarboxylic acids and derivatives Vinylogous amides Alkyl nitrates Carbamate esters Methyl esters Enoate esters Organic nitro compounds Organic nitric acids and derivatives Carboxylic acid salts Azacyclic compounds Enamines Carboxylic acids Dialkyl ethers Dialkylamines Hydrocarbon derivatives Carbonyl compounds Organic salts Organic oxides Organochlorides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Chlorobenzene - Aralkylamine - Tetrahydropyridine - Aryl chloride - Aryl halide - Carbonic acid diester - Dicarboxylic acid or derivatives - Hydropyridine - Alkyl nitrate - Organic nitrate - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carbamic acid ester - Methyl ester - Carboxylic acid ester - Carboxylic acid salt - Organic nitro compound - Carbonic acid derivative - Organic nitric acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Carboxylic acid - Dialkyl ether - Secondary aliphatic amine - Ether - Enamine - Azacycle - Organic salt - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Amine - Organic oxide - Carbonyl group - Organochloride - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
External Descriptors
Not available