Structure Information
Structure

Compound Identification

SMILES

NC1=NC(NCCCCCO)=C\C(N1)=C1/C=C(C=CC1=O)C1=CC=C(O)C=C1

InChIKey

InChIKey=DHUGUMOBDQCCFQ-ZCXUNETKSA-N

Formula

C21H24N4O3

Mass

380.448

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones - Quinomethanes

Direct Parent

O-quinomethanes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

O-quinomethane - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Hydropyrimidine - 1,6-dihydropyrimidine - Benzenoid - Vinylogous amide - Guanidine - Ketene acetal or derivatives - Alkanolamine - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Alcohol - Hydrocarbon derivative - Amine - Organonitrogen compound - Organic nitrogen compound - Primary alcohol - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.

External Descriptors

Not available

Previous Back Next