Compound Identification
SMILES
[O-]C(=O)[C@H](OC(=O)COCC(=O)OCC(CO[N+]([O-])=O)(CO[N+]([O-])=O)CO[N+]([O-])=O)[C@@H](NC(=O)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=DOMDFTHDGADFIU-FCHUYYIVSA-M
Formula
C25H25N4O17
Mass
653.487
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Benzamides
- Level 6 N-benzylbenzamides
-
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
Phenylpropanoic acids Beta amino acids and derivatives Tricarboxylic acids and derivatives Benzoyl derivatives Monosaccharides Alkyl nitrates Secondary carboxylic acid amides Carboxylic acid esters Carboxylic acid salts Organic nitric acids and derivatives Organic nitro compounds Dialkyl ethers Carboxylic acids Organic salts Hydrocarbon derivatives Organic oxides Carbonyl compounds Organonitrogen compounds Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-benzylbenzamide - Beta amino acid or derivatives - 3-phenylpropanoic-acid - Tricarboxylic acid or derivatives - Benzoyl - Monosaccharide - Organic nitrate - Alkyl nitrate - Carboxamide group - Organic nitric acid or derivatives - Organic nitro compound - Secondary carboxylic acid amide - Carboxylic acid salt - Carboxylic acid ester - Carboxylic acid derivative - Ether - Dialkyl ether - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic cation - Aromatic homomonocyclic 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