Compound Identification
SMILES
[Na+].COC1=C(OC)C=C(C(CN(CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C2=NC=C(OCCCC([O-])=O)C=C2)=C1)C1=CC(=CC(C(C)C)=C1OC)C(C)C
InChIKey
InChIKey=MITOYCNHMWLMJO-UHFFFAOYSA-M
Formula
C40H43F6N2NaO6
Mass
784.772
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzylamines
- Level 5 2-benzylaminopyridines
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Subclass
Benzylamines
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzylamines
Intermediate Tree Nodes
Not available
Direct Parent
2-benzylaminopyridines
Alternative Parents
Biphenyls and derivatives Trifluoromethylbenzenes Dimethoxybenzenes Phenylpropanes Cumenes Phenoxy compounds Dialkylarylamines Anisoles Alkyl aryl ethers Aminopyridines and derivatives Imidolactams Heteroaromatic compounds Carboxylic acid salts Organic metal halides Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic sodium salts Organic zwitterions Alkyl fluorides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-benzylaminopyridine - Biphenyl - Trifluoromethylbenzene - O-dimethoxybenzene - Dimethoxybenzene - Cumene - Phenylpropane - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Dialkylarylamine - Alkyl aryl ether - Aminopyridine - Pyridine - Imidolactam - Heteroaromatic compound - Carboxylic acid salt - Organic alkali metal salt - Organic metal halide - Carboxylic acid derivative - Organoheterocyclic compound - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Azacycle - Organohalogen compound - Organic sodium salt - Hydrocarbon derivative - Organic oxygen compound - Amine - Alkyl halide - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl fluoride - Organic oxide - Organic nitrogen compound - Organic zwitterion - Organic salt - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-benzylaminopyridines. These are aromatic compounds containing pyridine ring substituted at the 2-position by a benzylamine group.
External Descriptors
Not available