Compound Identification
SMILES
ClC1=CC(Cl)=C(C=C1)C(=O)N1CC[NH+](CC2=CC=CC=C2)CC1
InChIKey
InChIKey=GWTQIXMTFMYDIK-UHFFFAOYSA-O
Formula
C18H19Cl2N2O
Mass
350.26
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- 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
Halobenzoic acids and derivatives
Direct Parent
4-halobenzoic acids and derivatives
Alternative Parents
2-halobenzoic acids and derivatives Benzamides Benzoyl derivatives Benzylamines Dichlorobenzenes Phenylmethylamines N-alkylpiperazines Aralkylamines Aryl chlorides Vinylogous halides Quaternary ammonium salts Tertiary carboxylic acid amides Amino acids and derivatives Trialkylamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Organooxygen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Benzamide - 1,3-dichlorobenzene - Phenylmethylamine - Benzoyl - Benzylamine - Halobenzene - Chlorobenzene - Aralkylamine - N-alkylpiperazine - Aryl halide - Piperazine - Aryl chloride - 1,4-diazinane - Tertiary carboxylic acid amide - Quaternary ammonium salt - Vinylogous halide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organooxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 4-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 4-position of the benzene ring.
External Descriptors
Not available