Compound Identification
SMILES
CC1(C)N(CC2=C1NN=C2NC(=O)C1=CC(F)=CC(F)=C1)C(=O)N1CCCC(O)C1
InChIKey
InChIKey=SVQQKTPFJTYHJP-UHFFFAOYSA-N
Formula
C20H23F2N5O3
Mass
419.433
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Halobenzoic acids and derivatives
Direct Parent
3-halobenzoic acids and derivatives
Alternative Parents
Piperidinecarboxamides Benzamides Pyrrolopyrazoles Benzoyl derivatives Fluorobenzenes Aryl fluorides Imidolactams Pyrroles Pyrazoles Heteroaromatic compounds Ureas Secondary carboxylic acid amides Secondary alcohols Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-halobenzoic acid or derivatives - Benzamide - 1-piperidinecarboxamide - Piperidinecarboxamide - Benzoyl - Pyrrolopyrazole - Halobenzene - Fluorobenzene - Imidolactam - Aryl halide - Aryl fluoride - Piperidine - Heteroaromatic compound - Azole - Pyrazole - Pyrrole - Urea - Secondary carboxylic acid amide - Carboxamide group - Secondary alcohol - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 3-position of the benzene ring.
External Descriptors
Not available