Compound Identification
SMILES
O[C@@H]([C@H]1COCCC1=O)C1=CC=CC=C1
InChIKey
InChIKey=ZDFZHZYWGCRUEP-CMPLNLGQSA-N
Formula
C12H14O3
Mass
206.241
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Oxanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Oxanes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Oxanes
Alternative Parents
Benzene and substituted derivatives Secondary alcohols Cyclic ketones Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives Aromatic alcohols Aldehydes
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Monocyclic benzene moiety - Oxane - Benzenoid - Cyclic ketone - Secondary alcohol - Ketone - Oxacycle - Ether - Dialkyl ether - Aromatic alcohol - Aldehyde - Organooxygen compound - Carbonyl group - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as oxanes. These are compounds containing an oxane (tetrahydropyran) ring, which is a six-member saturated aliphatic heterocycle with one oxygen atom and five carbon atoms.
External Descriptors
Not available