Compound Identification
SMILES
CC1=CC=C(C=C1)S([O-])(=O)=O.C[C@@H](O[C@H]1OCC[NH2+][C@H]1C1=CC=C(F)C=C1)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F
InChIKey
InChIKey=SQSDKFVTNMLFGV-YNXGUESPSA-N
Formula
C27H26F7NO5S
Mass
609.56
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Oxazinanes
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Subclass
Morpholines
- Level 5 Phenylmorpholines
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Subclass
Morpholines
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Class
Oxazinanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Oxazinanes
Subclass
Morpholines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylmorpholines
Alternative Parents
p-Methylbenzenesulfonates Trifluoromethylbenzenes Tosyl compounds 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Aralkylamines Fluorobenzenes Aryl fluorides Sulfonyls Organosulfonic acids Oxacyclic compounds Acetals Azacyclic compounds Dialkylamines Alkyl fluorides Organofluorides Organic oxides Organopnictogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Phenylmorpholine - P-methylbenzenesulfonate - Benzenesulfonate - Trifluoromethylbenzene - Tosyl compound - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - Fluorobenzene - Halobenzene - Toluene - Aralkylamine - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Oxacycle - Azacycle - Secondary amine - Secondary aliphatic amine - Acetal - Hydrocarbon derivative - Amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl fluoride - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Organopnictogen compound - Organic oxide - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylmorpholines. These are aromatic compounds containing a morpholine ring and a benzene ring linked to each other through a CC or a CN bond.
External Descriptors
Not available