Compound Identification
SMILES
COC(OC)[C@@]1(C)OC2=C(C=C(C=C2)[N+]([O-])=O)[C@H]([C@@H]1O)N(CC1=NN(C)N=N1)C1=CC=C(C=C1)C(F)(F)F
InChIKey
InChIKey=YDIWNBIOXVXABF-URVUXULASA-N
Formula
C23H25F3N6O6
Mass
538.484
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
1-benzopyrans Aniline and substituted anilines Dialkylarylamines Nitroaromatic compounds Alkyl aryl ethers Aralkylamines Tetrazoles Heteroaromatic compounds Secondary alcohols 1,2-aminoalcohols Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Acetals Organic salts Organic zwitterions Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chromane - Benzopyran - 1-benzopyran - Trifluoromethylbenzene - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Alkyl aryl ether - Aralkylamine - Heteroaromatic compound - Azole - Tetrazole - Organic nitro compound - 1,2-aminoalcohol - C-nitro compound - Secondary alcohol - Tertiary amine - Oxacycle - Azacycle - Ether - Organoheterocyclic compound - Organic oxoazanium - Acetal - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organofluoride - Alkyl fluoride - Organohalogen compound - Organopnictogen compound - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic salt - Alkyl halide - Amine - Organic oxygen compound - Organic zwitterion - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors
Not available