Structure Information
Structure

Compound Identification

SMILES

CC1(C)OC2=C(C=C(C=C2)C#N)C(=C1)N1C=CC(CO[N+]([O-])=O)=CC1=O

InChIKey

InChIKey=PADAPMNSGLDVBI-UHFFFAOYSA-N

Formula

C18H15N3O5

Mass

353.334

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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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2,2-dimethyl-1-benzopyran - Alkyl aryl ether - Dihydropyridine - Pyridinone - Hydropyridine - Pyridine - Benzenoid - Organic nitrate - Heteroaromatic compound - Alkyl nitrate - Lactam - Organic nitric acid or derivatives - Organic nitro compound - Ether - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Cyanide - Organic salt - Organic oxide - Organic cation - 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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