Structure Information
Structure

Compound Identification

SMILES

COC1=CC(OC)=CC(NC2=C(C(N)=O)C3=NC=CN3C(NCC3CCCN(C3)C(=O)C(=C/C3CC3)\C#N)=N2)=C1

InChIKey

InChIKey=NKLJAQCDKBUTRA-GRSHGNNSSA-N

Formula

C28H32N8O4

Mass

544.616

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Methoxybenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Dimethoxybenzenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dimethoxybenzene - M-dimethoxybenzene - Pyrimidine-5-carboxylic acid or derivatives - Pyrimidinecarboxamide - Methoxyaniline - N-acyl-piperidine - Imidazopyrimidine - Phenol ether - Phenoxy compound - Aniline or substituted anilines - Anisole - Alkyl aryl ether - Aminopyrimidine - Imidolactam - N-substituted imidazole - Pyrimidine - Piperidine - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Tertiary carboxylic acid amide - Primary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Ether - Carbonitrile - Nitrile - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Cyanide - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.

External Descriptors

Not available

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