Compound Identification
SMILES
COC1=CC=C(C=C1)[C@H](CNC1=C(C=C(C=C1)S(C)(=O)=O)[N+]([O-])=O)N(C)C
InChIKey
InChIKey=LCKHVHBZZWVGMI-SFHVURJKSA-N
Formula
C18H23N3O5S
Mass
393.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Aniline and substituted anilines
- Level 5 Sulfonylanilines
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Subclass
Aniline and substituted anilines
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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
Aniline and substituted anilines
Intermediate Tree Nodes
Not available
Direct Parent
Sulfonylanilines
Alternative Parents
Benzenesulfonyl compounds Nitrobenzenes Anisoles Methoxybenzenes Nitroaromatic compounds Phenoxy compounds Phenylalkylamines Alkyl aryl ethers Secondary alkylarylamines Sulfones Trialkylamines Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Organic salts Organic oxides Organic zwitterions Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Sulfonylaniline - Nitrobenzene - Benzenesulfonyl group - Phenoxy compound - Nitroaromatic compound - Anisole - Phenol ether - Methoxybenzene - Phenylalkylamine - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Aralkylamine - Sulfone - Sulfonyl - C-nitro compound - Organic nitro compound - Tertiary amine - Tertiary aliphatic amine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Ether - Organic oxoazanium - Organic salt - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Amine - Organic oxygen compound - Organic zwitterion - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as sulfonylanilines. These are compounds containing an aniline moiety, which is para-substituted by a sulfonyl group.
External Descriptors
Not available