Compound Identification
SMILES
COC1=C(F)C=C(C=C1)C(N1CCCC(C1)C(O)=O)C1=CC2=CC=CC=C2S1
InChIKey
InChIKey=ZJDSDIWPMFBNPT-UHFFFAOYSA-N
Formula
C22H22FNO3S
Mass
399.48
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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-benzothiophenes 2,3,5-trisubstituted thiophenes Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Fluorobenzenes Aralkylamines Aryl fluorides Heteroaromatic compounds Trialkylamines Amino acids Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzothiophene - Benzothiophene - Piperidinecarboxylic acid - Phenoxy compound - Anisole - Methoxybenzene - 2,3,5-trisubstituted thiophene - Phenol ether - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Monocyclic benzene moiety - Benzenoid - Aryl halide - Heteroaromatic compound - Thiophene - Tertiary aliphatic amine - Amino acid - Amino acid or derivatives - Tertiary amine - Azacycle - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic 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