Compound Identification
SMILES
COC1=CC([C@@H]2CCCN2C(=O)C[NH2+][C@H](C)C2=CC=C(Cl)C=C2)=C(OC)C=C1
InChIKey
InChIKey=DPJKDBGWDKUDKR-QRWLVFNGSA-O
Formula
C22H28ClN2O3
Mass
403.93
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
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Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid amides
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Alpha amino acid amides
Alternative Parents
Phenylpyrrolidines Dimethoxybenzenes Phenoxy compounds Anisoles N-acylpyrrolidines Alkyl aryl ethers Aralkylamines Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Quaternary ammonium salts Pyrroles Dialkylamines Azacyclic compounds Organochlorides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid amide - 2-phenylpyrrolidine - P-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - N-acylpyrrolidine - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrrolidine - Quaternary ammonium salt - Pyrrole - Tertiary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Secondary aliphatic amine - Secondary amine - Ether - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organochloride - Hydrocarbon derivative - Organic oxide - Amine - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids.
External Descriptors
Not available