Compound Identification
SMILES
COC1=C(OC)C(Br)=CC(=C1)C1NC(CC2CCCCC2)(C2C1C(=O)N(C2=O)C1=CC=C(C=C1)C(C)=O)C(O)=O
InChIKey
InChIKey=RWRAMPOJVBGDQX-UHFFFAOYSA-N
Formula
C30H33BrN2O7
Mass
613.505
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
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
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Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
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 Alpha amino acids Dimethoxybenzenes Acetophenones Carbocyclic fatty acids Pyrrolidine carboxylic acids Phenoxy compounds Anisoles Aryl alkyl ketones Benzoyl derivatives Alkyl aryl ethers Aralkylamines Bromobenzenes Pyrrolidine-2-ones N-substituted carboxylic acid imides Aryl bromides Pyrroles Dicarboximides Lactams Amino acids Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylamines Hydrocarbon derivatives Organobromides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - 2-phenylpyrrolidine - 1-phenylpyrrolidine - Alpha-amino acid - Alpha-amino acid or derivatives - Dimethoxybenzene - O-dimethoxybenzene - Acetophenone - Carbocyclic fatty acid - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Phenoxy compound - Phenol ether - Methoxybenzene - Aryl alkyl ketone - Benzoyl - Anisole - Halobenzene - Aralkylamine - Bromobenzene - Alkyl aryl ether - Fatty acyl - Benzenoid - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Aryl halide - Aryl bromide - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide - Dicarboximide - Pyrrolidine - Pyrrole - Amino acid or derivatives - Lactam - Amino acid - Azacycle - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Ether - Secondary aliphatic amine - Carboxylic acid derivative - Carboxylic acid - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - 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