Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

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

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

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