Structure Information
Structure

Compound Identification

SMILES

COS([O-])(=O)=O.C[N+]1(C)C2CCC1CC(C2)=C1C2=CC=CC=C2CCC2=CC=CC=C12

InChIKey

InChIKey=JUVYOALUDRNTGG-UHFFFAOYSA-M

Formula

C25H31NO4S

Mass

441.59

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Dibenzocycloheptenes

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Dibenzocycloheptenes

Alternative Parents

Molecular Framework

Not available

Substituents

Dibenzocycloheptene - Tropane alkaloid - Sulfuric acid ester - Alkyl sulfate - N-alkylpyrrolidine - Sulfate-ester - Sulfuric acid monoester - Piperidine - Tetraalkylammonium salt - Quaternary ammonium salt - Pyrrolidine - Organic sulfuric acid or derivatives - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dibenzocycloheptenes. These are compounds containing a dibenzocycloheptene moiety, which consists of two benzene rings connected by a cycloheptene ring.

External Descriptors

Not available

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