Compound Identification
SMILES
[O-][N+](=O)C1=CC(=C(NCC2=CC(Cl)=CC=C2)C=C1)S(=O)(=O)N1CCOCC1
InChIKey
InChIKey=ISLBFOVQVWLTFN-UHFFFAOYSA-N
Formula
C17H18ClN3O5S
Mass
411.86
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Phenylmethylamines
- Level 5 Phenylbenzamines
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Subclass
Phenylmethylamines
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbenzamines
Alternative Parents
Aminobenzenesulfonamides Benzenesulfonyl compounds Nitrobenzenes Aniline and substituted anilines Benzylamines Nitroaromatic compounds Phenylalkylamines Chlorobenzenes Secondary alkylarylamines Aryl chlorides Morpholines Organosulfonamides Sulfonyls Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Dialkyl ethers Oxacyclic compounds Azacyclic compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbenzamine - Aminobenzenesulfonamide - Benzenesulfonamide - Benzenesulfonyl group - Nitrobenzene - Nitroaromatic compound - Benzylamine - Phenylalkylamine - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aralkylamine - Aryl chloride - Aryl halide - Morpholine - Oxazinane - Organosulfonic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic nitro compound - C-nitro compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Secondary amine - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Dialkyl ether - Ether - Oxacycle - Organic oxoazanium - Azacycle - Organic zwitterion - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Amine - Organic nitrogen compound - Organic salt - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbenzamines. These are aromatic compounds consisting of a benzyl group that is N-linked to a benzamine.
External Descriptors
Not available