Compound Identification
SMILES
COc1ccc2c(nn(Cn3cc[n+](Cc4ccc(o4)[N+]([O-])=O)c3)c2c1C#CC)C(=O)c1cc(OC)c(OC)c(OC)c1
InChIKey
InChIKey=FRCVDPOMEPOLHM-UHFFFAOYSA-N
Formula
C30H28N5O8
Mass
586.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoyl derivatives
- Level 5 Benzoylpyrazoles
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Subclass
Benzoyl derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoyl derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoylpyrazoles
Alternative Parents
Aryl-phenylketones Indazoles Phenoxy compounds Nitrofurans Nitroaromatic compounds Methoxybenzenes Anisoles Alkyl aryl ethers N-substituted imidazoles Heteroaromatic compounds Oxacyclic compounds Haloacetylenes and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxoanionic compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoylpyrazole - Aryl-phenylketone - Benzopyrazole - Phenoxy compound - Nitroaromatic compound - Methoxybenzene - Aryl ketone - Phenol ether - 2-nitrofuran - Anisole - Alkyl aryl ether - N-substituted imidazole - Heteroaromatic compound - Furan - Azole - Organic nitro compound - C-nitro compound - Ketone - Haloacetylene or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic hyponitrite - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoylpyrazoles. These are aromatic compounds containing a benzoyl group substituted with a pyrazole ring.
External Descriptors
Not available