Compound Identification
SMILES
CC1=CC=C(C=C1)S([O-])(=O)=O.ClC1=CC=CC(N2CCOCC2)=C1[N+]#N
InChIKey
InChIKey=MZOZIWJFBRHCHH-UHFFFAOYSA-M
Formula
C17H18ClN3O4S
Mass
395.86
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 Tosyl compounds 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Aniline and substituted anilines Dialkylarylamines Chlorobenzenes Aryl chlorides Sulfonyls Organosulfonic acids Organic diazonium salts Dialkyl ethers Azacyclic compounds Oxacyclic compounds Organic oxides Organochlorides Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Phenylmorpholine - P-methylbenzenesulfonate - Benzenesulfonate - Tosyl compound - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Halobenzene - Chlorobenzene - Toluene - Monocyclic benzene moiety - Aryl halide - Benzenoid - Aryl chloride - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Tertiary amine - Organic diazonium salt - Oxacycle - Dialkyl ether - Ether - Azacycle - Amine - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - 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