Compound Identification
SMILES
COC1=C(C=C(C=C1)C(=O)C1=C(N)N=C(NC2=CC=C(C=C2)N2CCC(CC2)N2CCOCC2)S1)[N+]([O-])=O
InChIKey
InChIKey=LYPXPGRSHDVDNY-UHFFFAOYSA-N
Formula
C26H30N6O5S
Mass
538.62
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
-
Level 7
Phenylketones
- Level 8 Aryl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
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Level 5
Ketones
-
Subclass
Carbonyl compounds
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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
Aryl-phenylketones
Alternative Parents
Phenylpiperidines Nitrophenyl ethers Methoxyanilines Methoxybenzenes Nitroaromatic compounds Dialkylarylamines Benzoyl derivatives Anisoles Phenoxy compounds 2,4,5-trisubstituted thiazoles Aminopiperidines Alkyl aryl ethers Morpholines Imidolactams 2-amino-1,3-thiazoles Vinylogous amides Heteroaromatic compounds Trialkylamines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Dialkyl ethers Primary amines Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Phenylpiperidine - Nitrophenyl ether - Methoxyaniline - Nitrobenzene - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Anisole - Benzoyl - Nitroaromatic compound - Phenol ether - Methoxybenzene - Phenoxy compound - 2,4,5-trisubstituted 1,3-thiazole - Aniline or substituted anilines - 4-aminopiperidine - Alkyl aryl ether - 1,3-thiazolamine - Monocyclic benzene moiety - Morpholine - Oxazinane - 1,3-thiazol-2-amine - Piperidine - Benzenoid - Imidolactam - Azole - Thiazole - Heteroaromatic compound - Vinylogous amide - C-nitro compound - Organic nitro compound - Tertiary aliphatic amine - Tertiary amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Azacycle - Oxacycle - Dialkyl ether - Ether - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Primary amine - Organic oxide - Organic zwitterion - Amine - Organonitrogen compound - Hydrocarbon derivative - Organic salt - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
External Descriptors
Not available