Compound Identification
SMILES
COC1=C(OC)C=C(CN2CCCN(CC(=O)NC3=C(F)C=C(F)C=C3)CC2)C(Br)=C1
InChIKey
InChIKey=COWAIQJFKBXWSP-UHFFFAOYSA-N
Formula
C22H26BrF2N3O3
Mass
498.369
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
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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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
Dimethoxybenzenes Anilides Phenylmethylamines Phenoxy compounds Anisoles N-arylamides Benzylamines 1,4-diazepanes Alkyl aryl ethers Aralkylamines Fluorobenzenes Bromobenzenes Aryl bromides Aryl fluorides Secondary carboxylic acid amides Trialkylamines Azacyclic compounds Organic oxides Organobromides Organofluorides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid amide - O-dimethoxybenzene - Dimethoxybenzene - Anilide - Phenoxy compound - Anisole - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - N-arylamide - 1,4-diazepane - Alkyl aryl ether - Bromobenzene - Diazepane - Fluorobenzene - Halobenzene - Aralkylamine - Benzenoid - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Ether - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Carbonyl group - Amine - Organic oxygen compound - Organohalogen compound - Organobromide - Organofluoride - Organonitrogen compound - Organooxygen compound - 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