Compound Identification
SMILES
[Br-].CC(C)C1=C(OCCCC[N+](C)(C)CC2=CC=C(Br)O2)C(Cl)=C(C)C=C1
InChIKey
InChIKey=AFLXICPWIWAGQQ-UHFFFAOYSA-M
Formula
C21H30Br2ClNO2
Mass
523.73
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Monoterpenoids
- Level 5 Aromatic monoterpenoids
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Subclass
Monoterpenoids
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
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 Phenylpropanes Cumenes Phenoxy compounds Phenol ethers Toluenes Alkyl aryl ethers Aralkylamines Chlorobenzenes Aryl bromides Aryl chlorides Tetraalkylammonium salts Furans Heteroaromatic compounds Oxacyclic compounds Organic bromide salts Organic zwitterions Organobromides Organochlorides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Cumene - Phenylpropane - Phenoxy compound - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Toluene - Aralkylamine - Benzenoid - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Quaternary ammonium salt - Heteroaromatic compound - Furan - Tetraalkylammonium salt - Oxacycle - Organoheterocyclic compound - Ether - Organic zwitterion - Organohalogen compound - Organobromide - Organopnictogen compound - Amine - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic salt - Organic nitrogen compound - Organic oxygen compound - Organic bromide salt - Aromatic heteromonocyclic 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