Compound Identification
SMILES
CC1=CC=C(C=C1)C1=CC2=C(OCCC(=C2)C(=O)NC2=CC=C(CP3(=O)OCCCO3)C=C2)C=C1
InChIKey
InChIKey=CXIMOPHHPLDKCQ-UHFFFAOYSA-N
Formula
C28H28NO5P
Mass
489.508
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxepines
Alternative Parents
Anilides N-arylamides Toluenes Dialkyl alkylphosphonates Alkyl aryl ethers Phosphonic acid esters Secondary carboxylic acid amides Oxacyclic compounds Organopnictogen compounds Organophosphorus compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxepine - Anilide - N-arylamide - Alkyl aryl ether - Dialkyl alkylphosphonate - Phosphonic acid diester - Toluene - Monocyclic benzene moiety - Phosphonic acid ester - Benzenoid - Organophosphonic acid derivative - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Ether - Oxacycle - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organophosphorus compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxepines. These are organic compounds containing a benzene ring fused to an oxepine ring (an unsaturated seven-membered heterocycle with one oxygen atom replacing a carbon atom).
External Descriptors
Not available