Compound Identification
SMILES
[Cl-].CN(C1=CC=C(C=C1)S(O)(=O)=O)C1=CC2=C(C=C1)C(C1=CC=CC=C1S(=O)(=O)N1CCC(CC1)C(=O)NCCOCCON1C=NC3=C1N=C(N)N=C3OCC1=CC=C(CNC(=O)C3=CC(=C(C=C3)C(O)=O)C3=C4C=CC(=O)C=C4OC4=C3C=CC(O)=C4)C=C1)=C1C=CC(C=C1O2)=[N+](C)C1=CC=C(C=C1)S(O)(=O)=O
InChIKey
InChIKey=HDBPYTKZWSYWKH-UHFFFAOYSA-N
Formula
C77H67ClN10O19S3
Mass
1568.06
Taxonomic Classification
Taxonomy Tree
-
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
-
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
Xanthenes Alkyldiarylamines Benzenesulfonamides Benzenesulfonic acids and derivatives Hypoxanthines 1-sulfo,2-unsubstituted aromatic compounds Piperidinecarboxamides Benzenesulfonyl compounds Benzoic acids Aniline and substituted anilines Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Aminopyrimidines and derivatives Organosulfonamides N-substituted imidazoles Sulfonyls Secondary ketimines Organosulfonic acids Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Cyclic ketones Azacyclic compounds Oxacyclic compounds Carboxylic acids Dialkyl ethers Hydrocarbon derivatives Organic chloride salts Organic oxides Organic zwitterions Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-benzylbenzamide - Dibenzopyran - Xanthene - Alkyldiarylamine - Hypoxanthine - Benzenesulfonate - 1-benzopyran - Benzopyran - Benzenesulfonamide - Imidazopyrimidine - Piperidinecarboxamide - Purine - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Benzoic acid - Benzoyl - Aniline or substituted anilines - Tertiary aliphatic/aromatic amine - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Alkyl aryl ether - Aminopyrimidine - Piperidine - Pyrimidine - N-substituted imidazole - Organosulfonic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Secondary ketimine - Imidazole - Azole - Organosulfonic acid - Sulfonyl - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Amino acid - Cyclic ketone - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Organic oxide - Organic zwitterion - Carbonyl group - Organic salt - Organic oxygen compound - Organic chloride salt - Amine - Hydrocarbon derivative - Primary amine - Organic nitrogen compound - Organosulfur compound - Organooxygen 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