Compound Identification
SMILES
[H+].[Cr+3].CCCCCCCCCCCCCN.CC1=NN(C(=O)C1=NN=C1C=CC(=CC1=O)N([O-])[O-])C1=CC=CC=C1.CC1=NN(C([O-])=C1N=NC1=C([O-])C=C(C=C1)[N+]([O-])=O)C1=CC=CC=C1
InChIKey
InChIKey=KRBVZBURERYVEY-UHFFFAOYSA-M
Formula
C45H52CrN11O8
Mass
926.976
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Pyrazoles
- Level 5 Phenylpyrazoles
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Subclass
Pyrazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrazoles
Alternative Parents
Nitrobenzenes Ketazines Nitroaromatic compounds Phenoxides Pyrazolones Heteroaromatic compounds Azo compounds Cyclic ketones Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids and derivatives Organic zwitterions Monoalkylamines Organopnictogen compounds Hydrocarbon derivatives Aldehydes Organic chromium salts Organic oxides
Molecular Framework
Not available
Substituents
Phenylpyrazole - Nitrobenzene - Nitroaromatic compound - Ketazine - Phenoxide - Azine - Monocyclic benzene moiety - Pyrazolinone - Benzenoid - Heteroaromatic compound - Pyrazoline - Azo compound - Ketone - C-nitro compound - Organic nitro compound - Cyclic ketone - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic transition metal salt - Carboxylic acid derivative - Organic oxoazanium - Organic salt - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic chromium salt - Primary aliphatic amine - Amine - Organopnictogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Primary amine - Organic nitrogen compound - Aldehyde - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.
External Descriptors
Not available