Compound Identification
SMILES
COC1=C(Br)C=C(C=C1)C(=O)C1C2C(C3C=C(C=CN13)C(=O)C1=CC=CC=C1)C(=O)N(C2=O)C1=CC=CC2=CC=CC=C12
InChIKey
InChIKey=ZTOQXMIUUIYQKD-UHFFFAOYSA-N
Formula
C35H25BrN2O5
Mass
633.498
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
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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
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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
Naphthalenes Anisoles Aryl alkyl ketones Phenoxy compounds Benzoyl derivatives Methoxybenzenes Alkyl aryl ethers Bromobenzenes Dihydropyridines Aryl bromides Pyrrolidine-2-ones N-substituted carboxylic acid imides Alpha-amino ketones Dicarboximides Trialkylamines Amino acids and derivatives Lactams Enamines Allylamines Azacyclic compounds Hydrocarbon derivatives Organobromides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Naphthalene - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Aryl alkyl ketone - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Dihydropyridine - Halobenzene - Monocyclic benzene moiety - 2-pyrrolidone - Pyrrolidone - Aryl halide - Benzenoid - Carboxylic acid imide, n-substituted - Aryl bromide - Pyrrolidine - Alpha-aminoketone - Carboxylic acid imide - Dicarboximide - Tertiary amine - Tertiary aliphatic amine - Lactam - Amino acid or derivatives - Allylamine - Organoheterocyclic compound - Azacycle - Enamine - Ether - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Amine - Organic nitrogen compound - Organohalogen compound - Organobromide - 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