Compound Identification
SMILES
COC1=C(OC)C=C(C=C(C#N)C(=O)NC2=CC=CC=C2C(O)=O)C(Br)=C1
InChIKey
InChIKey=MZSIXMNHRHSPFO-UHFFFAOYSA-N
Formula
C19H15BrN2O5
Mass
431.242
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Cinnamic acids and derivatives
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Subclass
Cinnamic acid amides
- Level 5 N-cinnamoylanthranilic acids
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Subclass
Cinnamic acid amides
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Class
Cinnamic acids and derivatives
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Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acid amides
Intermediate Tree Nodes
Not available
Direct Parent
N-cinnamoylanthranilic acids
Alternative Parents
Acylaminobenzoic acid and derivatives Dimethoxybenzenes Anilides Benzoic acids Phenoxy compounds N-arylamides Anisoles Benzoyl derivatives Alkyl aryl ethers Bromobenzenes Aryl bromides Vinylogous amides Secondary carboxylic acid amides Nitriles Carboxylic acids Hydrocarbon derivatives Organobromides Organic oxides Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-cinnamoylanthranilic acid - Acylaminobenzoic acid or derivatives - O-dimethoxybenzene - Dimethoxybenzene - Benzoic acid or derivatives - Benzoic acid - Anilide - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Methoxybenzene - N-arylamide - Alkyl aryl ether - Bromobenzene - Halobenzene - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Vinylogous amide - Secondary carboxylic acid amide - Carboxamide group - Ether - Carboxylic acid - Carboxylic acid derivative - Carbonitrile - Nitrile - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Cyanide - Organic oxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-cinnamoylanthranilic acids. These are aromatic compounds containing a cinnamic acid conjugated to an anthranilic acid.
External Descriptors
Not available