Compound Identification
SMILES
[Br-].CC(C)C1=C(OCCCC[N+](C)(C)CC2=CC=C(O2)[N+]([O-])=O)C=C(C)C(Cl)=C1
InChIKey
InChIKey=JSUYRNUGISWJMY-UHFFFAOYSA-M
Formula
C21H30BrClN2O4
Mass
489.84
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
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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 Nitroaromatic compounds Nitrofurans Toluenes Alkyl aryl ethers Aralkylamines Chlorobenzenes Aryl chlorides Tetraalkylammonium salts Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Organopnictogen compounds Organic zwitterions Organochlorides Hydrocarbon derivatives Organic oxides Organic bromide salts
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Monocyclic monoterpenoid - P-cymene - Aromatic monoterpenoid - Phenylpropane - Cumene - Phenol ether - 2-nitrofuran - Phenoxy compound - Nitroaromatic compound - Halobenzene - Alkyl aryl ether - Aralkylamine - Toluene - Chlorobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Tetraalkylammonium salt - Heteroaromatic compound - Furan - Quaternary ammonium salt - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Oxacycle - Ether - Organic oxoazanium - Organoheterocyclic compound - Organic salt - Organic bromide salt - Organohalogen compound - Organochloride - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organic zwitterion - 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