Compound Identification
SMILES
OC1=C(Br)C=C(C[C@@H](OC(=O)N2CCC(CC2)N2CCC3=CC=CC=C3NC2=O)C(=O)N2CCC(CC2)C2CCN(CC2)S(=O)(=O)C2CC2)C=C1
InChIKey
InChIKey=MDLHFOIGXYZODQ-UUWRZZSWSA-N
Formula
C37H48BrN5O7S
Mass
786.78
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
N-acylpiperidines O-bromophenols 1-hydroxy-2-unsubstituted benzenoids Bromobenzenes Aryl bromides Organosulfonamides Organic sulfonamides Tertiary carboxylic acid amides Sulfonyls Carbamate esters Ureas Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organobromides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-piperidine - Piperidinecarboxylic acid - 2-halophenol - 2-bromophenol - Bromobenzene - Halobenzene - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Benzenoid - Organosulfonic acid amide - Organic sulfonic acid amide - Monocyclic benzene moiety - Aryl bromide - Aryl halide - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carbamic acid ester - Urea - Carboxamide group - Carboxylic acid derivative - Azacycle - Organohalogen compound - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organosulfur compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organobromide - Organonitrogen compound - 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