Compound Identification
SMILES
ClC1=CC=CC(CNC(=O)C2=CC(NC(=O)C3=CC4=CN=C(N=C4NC3=O)N3CCOCC3)=C(Cl)C=C2)=C1
InChIKey
InChIKey=MDQVRKKCIRVAKN-UHFFFAOYSA-N
Formula
C26H22Cl2N6O4
Mass
553.4
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
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Level 5
Benzamides
- Level 6 N-benzylbenzamides
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Level 5
Benzamides
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Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Benzamides
Direct Parent
N-benzylbenzamides
Alternative Parents
Aromatic anilides Pyrido[2,3-d]pyrimidines 4-halobenzoic acids and derivatives Pyrimidinecarboxamides Pyridinecarboxylic acids and derivatives Benzoyl derivatives Dialkylarylamines Chlorobenzenes Pyridinones Aminopyrimidines and derivatives Morpholines Aryl chlorides Vinylogous amides Heteroaromatic compounds Lactams Secondary carboxylic acid amides Amino acids and derivatives Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-benzylbenzamide - Aromatic anilide - Pyridopyrimidine - Pyrido[2,3-d]pyrimidine - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Pyrimidinecarboxamide - Pyridine carboxylic acid or derivatives - Benzoyl - Dialkylarylamine - Halobenzene - Chlorobenzene - Aminopyrimidine - Pyridinone - Oxazinane - Aryl halide - Pyridine - Pyrimidine - Aryl chloride - Morpholine - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Secondary carboxylic acid amide - Tertiary amine - Carboxamide group - Lactam - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Oxacycle - Ether - Dialkyl ether - Organooxygen compound - Amine - Organohalogen compound - Organochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-benzylbenzamides. These are compounds containing a benzamide moiety that is N-linked to a benzyl group.
External Descriptors
Not available