Structure Information
Structure

Compound Identification

SMILES

[O-][Cl](=O)(=O)=O.CCNC1=C(C)C=C2C(OC3=CC(=[NH+]CC)C(C)=CC3=C2CCC(O)=O)=C1

InChIKey

InChIKey=YWLGQYDVSLBBTP-UHFFFAOYSA-N

Formula

C22H27ClN2O7

Mass

466.92

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrans

Subclass

1-benzopyrans

Intermediate Tree Nodes

Dibenzopyrans

Direct Parent

Xanthenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Xanthene - Secondary aliphatic/aromatic amine - Organic perchlorate - Organic perchlorate salt - Benzenoid - Heteroaromatic compound - Secondary ketimine - Amino acid or derivatives - Organic chlorate - Amino acid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Secondary amine - Oxacycle - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Amine - Organic salt - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as xanthenes. These are polycyclic aromatic compounds containing a xanthene moiety, which consists of two benzene rings joined to each other by a pyran ring.

External Descriptors

Not available

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