Compound Identification
SMILES
CO\N=C(/CN(C)C(=O)C1=CC(Cl)=CC(Cl)=C1)[C@H](CCN1CCC(CC1)N1CCCN(CCC(O)=O)C1=O)C1=CC(Cl)=C(Cl)C=C1
InChIKey
InChIKey=DBRMFIZNZXCKAM-ABASDMJMSA-N
Formula
C32H39Cl4N5O5
Mass
715.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
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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
Halobenzoic acids and derivatives
Direct Parent
3-halobenzoic acids and derivatives
Alternative Parents
Benzamides Benzoyl derivatives Dichlorobenzenes Aralkylamines Pyrimidones Aryl chlorides Diazinanes Piperidines Tertiary carboxylic acid amides Amino acids Ureas Trialkylamines Oxime ethers Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-halobenzoic acid or derivatives - Benzamide - 1,3-dichlorobenzene - Benzoyl - 1,2-dichlorobenzene - Halobenzene - Aralkylamine - Chlorobenzene - Pyrimidone - Aryl chloride - Aryl halide - 1,3-diazinane - Piperidine - Pyrimidine - Tertiary carboxylic acid amide - Tertiary amine - Oxime ether - Tertiary aliphatic amine - Urea - Carboxamide group - Amino acid - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 3-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 3-position of the benzene ring.
External Descriptors
Not available