Compound Identification
SMILES
CC(C)C1=C(OCCCC[N+](C)(C)CC2=CC=C(O2)[N+]([O-])=O)C=C(C)C(Cl)=C1
InChIKey
InChIKey=JEPPLJHEBOKUEC-UHFFFAOYSA-N
Formula
C21H30ClN2O4
Mass
409.93
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 Nitrofurans Nitroaromatic compounds Toluenes Alkyl aryl ethers Aralkylamines Chlorobenzenes Aryl chlorides Tetraalkylammonium salts Heteroaromatic compounds Oxacyclic compounds Organic oxoazanium compounds Organic oxides Organopnictogen compounds Organic salts Organochlorides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Phenylpropane - Cumene - Phenoxy compound - Nitroaromatic compound - 2-nitrofuran - Phenol ether - Alkyl aryl ether - Halobenzene - Toluene - Aralkylamine - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tetraalkylammonium salt - Heteroaromatic compound - Quaternary ammonium salt - Furan - Organic nitro compound - C-nitro compound - Oxacycle - Organoheterocyclic compound - Ether - Organic oxoazanium - Organooxygen compound - Organic salt - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organochloride - Organic oxygen compound - Organohalogen compound - Organic cation - 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