Structure Information
Structure

Compound Identification

SMILES

CC1(C)OC2=C(C=C(C=C2)C#N)[C@H](NC2=C(Br)C(=O)CC2)[C@H]1O

InChIKey

InChIKey=PSSCYMQXPDCWDR-JKSUJKDBSA-N

Formula

C17H17BrN2O3

Mass

377.238

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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 - Aralkylamine - Benzenoid - Alpha-haloketone - Vinylogous amide - 1,2-aminoalcohol - Ketone - Secondary alcohol - Cyclic ketone - Secondary aliphatic amine - Enamine - Ether - Carbonitrile - Nitrile - Vinyl bromide - Vinyl halide - Oxacycle - Bromoalkene - Haloalkene - Organohalogen compound - Amine - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Organic oxygen compound - Cyanide - 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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