Compound Identification
SMILES
CCOC(=O)[C@@H]1CCCN(CC2=NC(N)=NC(NC3=CC=C(Cl)C=C3)=N2)C1
InChIKey
InChIKey=MNWJZOZMMDIQRO-GFCCVEGCSA-N
Formula
C18H23ClN6O2
Mass
390.87
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Piperidines
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Subclass
Piperidinecarboxylic acids and derivatives
- Level 5 Piperidinecarboxylic acids
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Subclass
Piperidinecarboxylic acids and derivatives
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Class
Piperidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Piperidinecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Piperidinecarboxylic acids
Alternative Parents
1,3,5-triazine-2,4-diamines Aniline and substituted anilines Aralkylamines Chlorobenzenes 1,3,5-triazines Aryl chlorides Heteroaromatic compounds Trialkylamines Amino acids and derivatives Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organochlorides Carbonyl compounds Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Piperidinecarboxylic acid - 2,4-diamine-s-triazine - Aniline or substituted anilines - Halobenzene - Amino-1,3,5-triazine - Aminotriazine - Chlorobenzene - Aralkylamine - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Triazine - Benzenoid - 1,3,5-triazine - Heteroaromatic compound - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as piperidinecarboxylic acids. These are compounds containing a piperidine ring which bears a carboxylic acid group.
External Descriptors
Not available