Compound Identification
SMILES
[Cl-].C[NH+](CCCOC(=O)C1=CC=C(N)C=C1)CC1=CC=CC=C1
InChIKey
InChIKey=BOMAHWOUBQICSQ-UHFFFAOYSA-N
Formula
C18H23ClN2O2
Mass
334.84
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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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 acid esters
Alternative Parents
Aminobenzoic acids and derivatives Phenylmethylamines Aniline and substituted anilines Benzoyl derivatives Benzylamines Aralkylamines Trialkylamines Amino acids and derivatives Carboxylic acid esters Monocarboxylic acids and derivatives Primary amines Organic chloride salts Organic oxides Organooxygen compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Aminobenzoic acid or derivatives - Benzoate ester - Benzoyl - Benzylamine - Phenylmethylamine - Aniline or substituted anilines - Aralkylamine - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Primary amine - Organic salt - Amine - Organic oxygen compound - Organic chloride salt - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available