Compound Identification
SMILES
OC(=O)C(F)(F)F.NCCCC[C@@H]1N=C(c2ccccc2)c2ccccc2N(Cc2ccc(OP(O)(O)=O)cc2)C1=O
InChIKey
InChIKey=LFIUATVVNHZZQF-BQAIUKQQSA-N
Formula
C28H29F3N3O7P
Mass
607.523
Taxonomic Classification
Taxonomy Tree
-
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
-
Subclass
Phosphate esters
-
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
1,4-benzodiazepines Alpha amino acids and derivatives Phenoxy compounds Tertiary carboxylic acid amides Alpha-halocarboxylic acids Ketimines Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Carbonyl compounds Alkyl fluorides Organofluorides Hydrocarbon derivatives Organic oxides Monoalkylamines
Molecular Framework
Not available
Substituents
Phenyl phosphate - 1,4-benzodiazepine - Benzodiazepine - Alpha-amino acid or derivatives - Phenoxy compound - Monocyclic benzene moiety - Benzenoid - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Ketimine - Lactam - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Carboxylic acid - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Amine - Imine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Primary amine - Primary aliphatic amine - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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