Structure Information
Structure

Compound Identification

SMILES

C[C@H](Cl)C(=O)OC1=CC=C(\C=N/NC(=O)COC2=CC(=C3C=CC4=C(C=C(C5=C4C3=C2C=C5)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O)C=C1

InChIKey

InChIKey=GYWVTXIFUNMTMT-WYHGRLSWSA-N

Formula

C28H21ClN2O13S3

Mass

725.11

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Pyrenes

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Pyrenes

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Pyrene - Phenanthrene - Naphthalene sulfonate - 1-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonic acid or derivatives - Naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - 2-naphthalene sulfonate - Naphthalene - Phenol ester - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Alpha-halocarboxylic acid derivative - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Alpha-halocarboxylic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid ester - Ether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Alkyl halide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Organic nitrogen compound - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrenes. These are compounds containing a pyrene moiety, which consists four fused benzene rings, resulting in a flat aromatic system.

External Descriptors

Not available

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