Structure Information
Structure

Compound Identification

SMILES

[Li+].CN(CC1CCC2=C(C=CC(OCC(C)(C)C)=C2)C1C1=CC=CC=C1)CC([O-])=O

InChIKey

InChIKey=KNMJXKVSQPKAFV-UHFFFAOYSA-M

Formula

C25H32LiNO3

Mass

401.48

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Tetralins

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Tetralins

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Alpha-amino acid - Alpha-amino acid or derivatives - Tetralin - Phenol ether - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Amino acid or derivatives - Tertiary aliphatic amine - Amino acid - Tertiary amine - Carboxylic acid salt - Ether - Carboxylic acid derivative - Organic lithium salt - Carboxylic acid - Monocarboxylic acid or derivatives - Organic alkali metal salt - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Carbonyl group - Organic salt - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.

External Descriptors

Not available

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