Compound Identification
SMILES
C[C@@H](C1=NC(=CS1)C1=CC=C(C=C1)C#N)[C@@](CN1C=NC=N1)(OCOC(=O)C1=CC(OP(O)(O)=O)=CC=C1)C1=C(F)C=C(F)C=C1
InChIKey
InChIKey=FGLPMUVJMIHIAQ-WWOZWPLTSA-N
Formula
C30H24F2N5O7PS
Mass
667.58
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Organic phosphoric acids and derivatives
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Subclass
Phosphate esters
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Level 5
Aryl phosphates
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Level 6
Aryl phosphomonoesters
- Level 7 Phenyl phosphates
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Level 6
Aryl phosphomonoesters
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Level 5
Aryl phosphates
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Subclass
Phosphate esters
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Class
Organic phosphoric acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Organic phosphoric acids and derivatives
Subclass
Phosphate esters
Intermediate Tree Nodes
Aryl phosphates - Aryl phosphomonoesters
Direct Parent
Phenyl phosphates
Alternative Parents
Benzoic acid esters Phenylpropanes Phenoxy compounds Benzonitriles Benzoyl derivatives 2,4-disubstituted thiazoles Fluorobenzenes Aryl fluorides Triazoles Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Nitriles Azacyclic compounds Acetals Organic oxides Organofluorides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl phosphate - Benzoate ester - Phenylpropane - Benzoic acid or derivatives - Benzonitrile - Benzoyl - Phenoxy compound - Fluorobenzene - 2,4-disubstituted 1,3-thiazole - Halobenzene - Aryl halide - Monocyclic benzene moiety - Benzenoid - Aryl fluoride - Azole - Heteroaromatic compound - 1,2,4-triazole - Thiazole - Carboxylic acid ester - Acetal - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organopnictogen compound - Cyanide - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl phosphates. These are aromatic organooxygen compounds containing a phosphate group, which is O-esterified with a phenyl group.
External Descriptors
Not available