Compound Identification
SMILES
NC(=O)C1=NN(C2=C1COC1=C2C=C(NC(=O)C2=C(Cl)C=C(N)C=C2)C=C1)C1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=QHDDPPCJAKBWHY-UHFFFAOYSA-N
Formula
C25H18ClN5O5
Mass
503.9
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- 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
Not available
Direct Parent
Aminobenzoic acids and derivatives
Alternative Parents
1-benzopyrans 2-halobenzoic acids and derivatives Benzamides Benzodioxoles Pyrazole-5-carboxamides 2-heteroaryl carboxamides Aniline and substituted anilines Benzoyl derivatives Alkyl aryl ethers Chlorobenzenes Aryl chlorides Primary aromatic amines Heteroaromatic compounds Vinylogous halides Secondary carboxylic acid amides Amino acids and derivatives Primary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Acetals Organochlorides Organopnictogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 1-benzopyran - Aminobenzoic acid or derivatives - Benzopyran - Benzodioxole - Benzamide - 2-heteroaryl carboxamide - Pyrazole-5-carboxamide - Aniline or substituted anilines - Benzoyl - Alkyl aryl ether - Halobenzene - Chlorobenzene - Primary aromatic amine - Aryl chloride - Aryl halide - Heteroaromatic compound - Azole - Vinylogous halide - Pyrazole - Carboxamide group - Secondary carboxylic acid amide - Primary carboxylic acid amide - Amino acid or derivatives - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Primary amine - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aminobenzoic acids and derivatives. These are benzoic acids (or derivative thereof) containing an amine group attached to the benzene moiety.
External Descriptors
Not available