Compound Identification
SMILES
CCOC(=O)C(NNC1=C(Cl)C=CC(=C1)C(F)(F)F)=[N+](C)C1CCN(C)CC1
InChIKey
InChIKey=RYBXWERXFSMLIG-UHFFFAOYSA-O
Formula
C18H25ClF3N4O2
Mass
421.87
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Alpha-imino acid and derivatives
- Level 5 Alpha-imino acid esters
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Subclass
Alpha-imino acid and derivatives
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Alpha-imino acid and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Alpha-imino acid esters
Alternative Parents
Trifluoromethylbenzenes Alpha amino acids and derivatives Phenylhydrazines Chlorobenzenes Piperidines Aryl chlorides Trialkylamines Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Alkyl fluorides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organofluorides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-imino acid ester - Alpha-amino acid or derivatives - Trifluoromethylbenzene - Phenylhydrazine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperidine - Benzenoid - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Amine - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organic oxide - Organic oxygen compound - Organofluoride - Carbonyl group - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Organonitrogen compound - Organooxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha-imino acid esters. These are ester derivatives of alpha-imino acids. They have the general structure RN=CC(=O)OR', where R = H, organyl group and R' = organyl group.
External Descriptors
Not available