Compound Identification
SMILES
COC1=C(C=C(Br)C=C1)C1NC(CC2=CC=C(O)C=C2)(C2C1C(=O)N(C2=O)C1=CC=C(C=C1)C(C)=O)C(O)=O
InChIKey
InChIKey=DADFFOGNVFPXDR-UHFFFAOYSA-N
Formula
C29H25BrN2O7
Mass
593.43
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
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Subclass
Carbonyl compounds
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Level 5
Ketones
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Level 6
Aryl ketones
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Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
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Level 7
Phenylketones
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Level 6
Aryl ketones
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Level 5
Ketones
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Subclass
Carbonyl compounds
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Class
Organooxygen compounds
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Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Alkyl-phenylketones
Alternative Parents
Phenylpyrrolidines Phenylpropanoic acids Amphetamines and derivatives Alpha amino acids Acetophenones Aryl alkyl ketones Anisoles Benzoyl derivatives Pyrrolidine carboxylic acids Methoxybenzenes Phenoxy compounds Aralkylamines Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Bromobenzenes Pyrrolidine-2-ones Aryl bromides N-substituted carboxylic acid imides Dicarboximides Pyrroles Lactams Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Organic oxides Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - 1-phenylpyrrolidine - 2-phenylpyrrolidine - 3-phenylpropanoic-acid - Alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Acetophenone - Phenoxy compound - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Phenol ether - Benzoyl - Aryl alkyl ketone - Methoxybenzene - Anisole - Bromobenzene - Alkyl aryl ether - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - 2-pyrrolidone - Carboxylic acid imide, n-substituted - Pyrrolidone - Pyrrole - Pyrrolidine - Dicarboximide - Carboxylic acid imide - Lactam - Amino acid or derivatives - Amino acid - Monocarboxylic acid or derivatives - Azacycle - Ether - Organoheterocyclic compound - Secondary aliphatic amine - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Organic nitrogen compound - Organic oxide - Organobromide - Hydrocarbon derivative - Organohalogen compound - Amine - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available