Structure Information
Structure

Compound Identification

SMILES

Cl[Ti]Cl.CC\C(NC1=CC=CC=C1)=C1\C=C(C)C=C(C1=O)C(C)(C)C

InChIKey

InChIKey=XFZBGCNPNWFJOK-OFBWAKGQSA-L

Formula

C20H25Cl2NOTi

Mass

414.19

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Monoterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Aromatic monoterpenoids

Alternative Parents

Monocyclic monoterpenoids O-quinomethanes Aniline and substituted anilines Vinylogous amides Organic transition metal salts Enamines Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Aromatic monoterpenoid - Monocyclic monoterpenoid - O-quinomethane - Quinomethane - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Ketone - Cyclic ketone - Enamine - Organic metal salt - Organic transition metal salt - Hydrocarbon derivative - Organic oxide - Amine - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring.

External Descriptors

Not available

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