Compound Identification
SMILES
[H+].[H+].[H+].[Cr+3].CCCCCCCCCCCCNCCO.CCCCCCCCCCCCNCCO.CCCCCCCCCCCCNCCO.CC1=NN(C(=O)C1=NN=C1C=C(C=CC1=O)N([O-])[O-])C1=CC=C(C=C1)S([O-])(=O)=O.CC1=NN(C([O-])=C1N=NC1=C([O-])C=CC(=C1)[N+]([O-])=O)C1=CC=C(C=C1)S([O-])(=O)=O
InChIKey
InChIKey=KEVDYBGJTFHPOF-UHFFFAOYSA-M
Formula
C74H116CrN13O17S2
Mass
1575.93
Taxonomic Classification
Taxonomy Tree
-
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
Metal p-nitrophenoxides Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Nitrobenzenes Nitroaromatic compounds Ketazines Phenoxides Pyrazolones Sulfonyls Organosulfonic acids Heteroaromatic compounds 1,2-aminoalcohols Azo compounds Cyclic ketones Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carboxylic acids and derivatives Dialkylamines Organic chromium salts Primary alcohols Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Phenylpyrazole - Metal p-nitrophenoxide - Benzenesulfonate - 1-sulfo,2-unsubstituted aromatic compound - Nitrobenzene - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Ketazine - Nitroaromatic compound - Phenoxide - Monocyclic benzene moiety - Azine - Pyrazolinone - Benzenoid - Organosulfonic acid - Heteroaromatic compound - Organosulfonic acid or derivatives - Sulfonyl - Pyrazoline - Organic sulfonic acid or derivatives - Organic nitro compound - Cyclic ketone - Azo compound - Ketone - C-nitro compound - 1,2-aminoalcohol - Alkanolamine - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Organic transition metal salt - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic salt - Amine - Organic nitrogen compound - Alcohol - Organic oxygen compound - Organic chromium salt - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Carbonyl group - Organic cation - 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