Structure Information
Structure

Compound Identification

SMILES

[O-]C(=O)CN1C=C([C@H](N2CCOCC2)C([O-])=O)C2=C1C=C(Br)C=C2

InChIKey

InChIKey=AMPBSQAXZHAGQX-HNNXBMFYSA-L

Formula

C16H15BrN2O5

Mass

395.21

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indolyl carboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Indole-3-acetic acid derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indole-3-acetic acid derivative - Alpha-amino acid - Alpha-amino acid or derivatives - N-alkylindole - 3-alkylindole - L-alpha-amino acid - Indole - Aralkylamine - Morpholine - Oxazinane - Substituted pyrrole - Aryl bromide - Dicarboxylic acid or derivatives - Benzenoid - Aryl halide - Pyrrole - Heteroaromatic compound - Tertiary aliphatic amine - Amino acid or derivatives - Amino acid - Carboxylic acid salt - Tertiary amine - Oxacycle - Carboxylic acid derivative - Azacycle - Carboxylic acid - Dialkyl ether - Ether - Organic oxide - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic anion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indole-3-acetic acid derivatives. These are compounds containing an acetic acid (or a derivative) linked to the C3 carbon atom of an indole.

External Descriptors

Not available

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