Structure Information
Structure

Compound Identification

SMILES

Cl.BrC1=CC=CC=C1CN1CC2COC3=C(C=C(C=C3)C#N)C2C1

InChIKey

InChIKey=CUGVBTPXVRKFLS-UHFFFAOYSA-N

Formula

C19H18BrClN2O

Mass

405.72

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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

1-benzopyrans

Alternative Parents

Phenylmethylamines Benzylamines Bromobenzenes Aralkylamines Alkyl aryl ethers N-alkylpyrrolidines Aryl bromides Trialkylamines Oxacyclic compounds Nitriles Azacyclic compounds Organobromides Hydrochlorides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-benzopyran - Benzylamine - Phenylmethylamine - Alkyl aryl ether - Bromobenzene - Halobenzene - Aralkylamine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Pyrrolidine - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Azacycle - Ether - Carbonitrile - Nitrile - Hydrochloride - Organohalogen compound - Hydrocarbon derivative - Organobromide - Cyanide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.

External Descriptors

Not available

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