Compound Identification
SMILES
CC1=C(NC(=O)C2=CC(=C(C=C2)N2OC(=C(CSCC(O)CO)C2=O)C(C)(C)C)[N+]([O-])=O)C=C(C=C1)S(O)(=O)=O
InChIKey
InChIKey=MABKIIWSNNTLRP-UHFFFAOYSA-N
Formula
C25H29N3O10S2
Mass
595.64
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
Anilides
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Level 5
Aromatic anilides
- Level 6 Benzanilides
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Level 5
Aromatic anilides
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Subclass
Anilides
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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
Anilides
Intermediate Tree Nodes
Aromatic anilides
Direct Parent
Benzanilides
Alternative Parents
p-Methylbenzenesulfonates 1-sulfo,2-unsubstituted aromatic compounds Benzamides Benzenesulfonyl compounds Nitrobenzenes Benzoyl derivatives Nitroaromatic compounds Toluenes Sulfonyls Organosulfonic acids Heteroaromatic compounds Isoxazoles 1,2-diols Secondary carboxylic acid amides Secondary alcohols Lactams Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Oxacyclic compounds Dialkylthioethers Organic oxoazanium compounds Primary alcohols Organic salts Hydrocarbon derivatives Organonitrogen compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzanilide - P-methylbenzenesulfonate - Benzenesulfonate - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Nitrobenzene - Benzoic acid or derivatives - Benzenesulfonyl group - Benzamide - Nitroaromatic compound - Benzoyl - Toluene - Azole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Isoxazole - Heteroaromatic compound - Sulfonyl - Organosulfonic acid - 1,2-diol - Carboxamide group - Lactam - C-nitro compound - Organic nitro compound - Secondary alcohol - Secondary carboxylic acid amide - Sulfenyl compound - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Organic 1,3-dipolar compound - Dialkylthioether - Oxacycle - Organic oxoazanium - Carboxylic acid derivative - Azacycle - Organic salt - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Alcohol - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary alcohol - Organic oxide - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzanilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with a benzene ring. They have the general structure RNC(=O)R', where R,R'= benzene.
External Descriptors
Not available