Compound Identification
SMILES
[O-]C(=O)COC1=C(C=CC(=C1)C1=CC2=C(N1)C=C(C=C2)C([O-])=O)N(CC([O-])=O)CC([O-])=O
InChIKey
InChIKey=PDDJAJCJQXFQCW-UHFFFAOYSA-J
Formula
C21H14N2O9
Mass
438.35
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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Subclass
Indoles
- Level 5 2-phenylindoles
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Subclass
Indoles
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Class
Indoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
2-phenylindoles
Alternative Parents
Indolecarboxylic acids Phenylpyrroles Phenoxyacetic acid derivatives Alpha amino acids Tricarboxylic acids and derivatives Aminophenyl ethers Phenoxy compounds Aniline and substituted anilines Dialkylarylamines Alkyl aryl ethers Heteroaromatic compounds Amino acids Carboxylic acid salts Carboxylic acids Azacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylindole - Indolecarboxylic acid derivative - Indolecarboxylic acid - 2-phenylpyrrole - Phenoxyacetate - Alpha-amino acid - Alpha-amino acid or derivatives - Aminophenyl ether - Tricarboxylic acid or derivatives - Phenol ether - Aniline or substituted anilines - Dialkylarylamine - Phenoxy compound - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Substituted pyrrole - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Pyrrole - Tertiary amine - Amino acid or derivatives - Amino acid - Carboxylic acid salt - Ether - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic anion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-phenylindoles. These are indoles substituted at the 2-position with a phenyl group.
External Descriptors
Not available