Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

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

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

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