Compound Identification
SMILES
CCOC(=O)C1=C(C)N=C2N=C(NN2C1C1=CC=C(C=C1)C(C)C)C(F)(F)F
InChIKey
InChIKey=ORVMULGVTYUWIG-UHFFFAOYSA-N
Formula
C19H21F3N4O2
Mass
394.398
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 Bicyclic 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
Bicyclic monoterpenoids
Alternative Parents
Aromatic monoterpenoids Triazolopyrimidines Phenylpropanes Cumenes Imidolactams Hydropyrimidines Triazolines Enoate esters Amidrazones Amidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Monocarboxylic acids and derivatives Alkyl fluorides Carbonyl compounds Organic oxides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
P-cymene - Aromatic monoterpenoid - Bicyclic monoterpenoid - Cumene - Triazolopyrimidine - Phenylpropane - Monocyclic benzene moiety - Imidolactam - Hydropyrimidine - Benzenoid - 1,6-dihydropyrimidine - Triazoline - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid amidrazone - Carboxylic acid ester - Amidine - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organic nitrogen compound - Alkyl fluoride - Carbonyl group - Alkyl halide - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other.
External Descriptors
Not available