Compound Identification
SMILES
Cn1c(ncc1[N+]([O-])=O)C(O)c1cc(F)cc(C2C3C[C@@H]4C[C@@H](C[C@H]2C4)C3)c1O
InChIKey
InChIKey=MSZILWMSIQRIMB-CRNZZKCFSA-N
Formula
C21H24FN3O4
Mass
401.438
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Cyclohexylphenols
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Cyclohexylphenols
Intermediate Tree Nodes
Not available
Direct Parent
Cyclohexylphenols
Alternative Parents
1,2,5-trisubstituted imidazoles Nitroaromatic compounds P-fluorophenols Nitroimidazoles Fluorobenzenes N-substituted imidazoles Aryl fluorides Heteroaromatic compounds Secondary alcohols Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic zwitterions Organic salts Organic oxides Organonitrogen compounds Hydrocarbon derivatives Aromatic alcohols Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclohexylphenol - 1,2,5-trisubstituted-imidazole - 4-halophenol - Nitroimidazole - 4-fluorophenol - Trisubstituted imidazole - Nitroaromatic compound - Fluorobenzene - Halobenzene - Phenol - N-substituted imidazole - Aryl fluoride - Aryl halide - Heteroaromatic compound - Imidazole - Azole - Secondary alcohol - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic zwitterion - Organohalogen compound - Organofluoride - Alcohol - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Aromatic alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cyclohexylphenols. These are compounds containing a cyclohexane lined to a phenol group.
External Descriptors
Not available