Compound Identification
SMILES
FC(F)OC1=CC=CC(=C1)C(=O)NCC(=O)OCC(=O)C1=CC2=C(OCC(=O)N2)C=C1
InChIKey
InChIKey=TWINJRKVQPXNKJ-UHFFFAOYSA-N
Formula
C20H16F2N2O7
Mass
434.352
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Benzamides
- Level 6 Hippuric acids and derivatives
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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
Hippuric acids and derivatives
Alternative Parents
Alpha amino acid esters N-acyl-alpha amino acids and derivatives Benzoxazinones Benzomorpholines Phenoxy compounds Phenol ethers Aryl alkyl ketones Benzoyl derivatives Alkyl aryl ethers Alpha-acyloxy ketones Secondary carboxylic acid amides Lactams Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds Alkyl fluorides Organopnictogen compounds Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Benzoxazinone - Alpha-amino acid or derivatives - Benzomorpholine - Benzoxazine - Phenoxy compound - Benzoyl - Phenol ether - Aryl ketone - Aryl alkyl ketone - Alpha-acyloxy ketone - Alkyl aryl ether - Oxazinane - Secondary carboxylic acid amide - Carboxamide group - Lactam - Ketone - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Alkyl fluoride - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organofluoride - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aldehyde - Alkyl halide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hippuric acids and derivatives. These are compounds containing a hippuric acid or a derivative, with a structure characterized the presence of a benzoyl group linked to the N-terminal of a glycine.
External Descriptors
Not available