Structure Information
Structure

Compound Identification

SMILES

CN1N=C(NC2C(O)C(C)(C)OC3=C2C=C(C=C3)C#N)C=CC1=O

InChIKey

InChIKey=VQSIKIJIQLINRC-UHFFFAOYSA-N

Formula

C17H18N4O3

Mass

326.356

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrans

Subclass

1-benzopyrans

Intermediate Tree Nodes

Not available

Direct Parent

2,2-dimethyl-1-benzopyrans

Alternative Parents

Pyridazinones Aminopyridazines Alkyl aryl ethers Imidolactams Benzenoids Heteroaromatic compounds Secondary alcohols Lactams Oxacyclic compounds Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Amines

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2,2-dimethyl-1-benzopyran - Alkyl aryl ether - Aminopyridazine - Pyridazinone - Pyridazine - Benzenoid - Imidolactam - Heteroaromatic compound - Lactam - Secondary alcohol - Nitrile - Carbonitrile - Ether - Oxacycle - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Cyanide - Organooxygen compound - Organonitrogen compound - Alcohol - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2,2-dimethyl-1-benzopyrans. These are organic compounds containing a 1-benzopyran moiety that carries two methyl groups at the 2-position.

External Descriptors

Not available

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