Compound Identification
SMILES
CC1=CC=C(C=C1)C(O)(CCN1CCCC1)C1=CC=CC(\C=C\C(O)=O)=N1
InChIKey
InChIKey=KBOVTNPKTWUFRD-VAWYXSNFSA-N
Formula
C22H26N2O3
Mass
366.461
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Not available
Direct Parent
Toluenes
Alternative Parents
Aralkylamines Pyridines and derivatives N-alkylpyrrolidines Tertiary alcohols Heteroaromatic compounds 1,3-aminoalcohols Trialkylamines Amino acids Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aralkylamine - Toluene - Pyridine - N-alkylpyrrolidine - 1,3-aminoalcohol - Pyrrolidine - Heteroaromatic compound - Tertiary alcohol - Amino acid or derivatives - Amino acid - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Organic nitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Aromatic alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane group.
External Descriptors
Not available