Compound Identification
SMILES
CN(CCCOC1=C(C=C(C=C1)[N+]([O-])=O)C1SC2=CC=CC=C2N1C(C)=O)C1CCCCC1
InChIKey
InChIKey=DVJSDFNMDMUHDO-UHFFFAOYSA-N
Formula
C25H31N3O4S
Mass
469.6
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
Subclass
Nitrobenzenes
- Level 5 Nitrophenyl ethers
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Subclass
Nitrobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrophenyl ethers
Alternative Parents
Benzothiazoles Nitroaromatic compounds Phenol ethers Phenoxy compounds Alkylarylthioethers Alkyl aryl ethers Cyclohexylamines Acetamides Tertiary carboxylic acid amides Thiazoles Trialkylamines Amino acids and derivatives Organic oxoazanium compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrophenyl ether - Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Phenoxy compound - Aryl thioether - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Cyclohexylamine - Alkylarylthioether - Acetamide - Tertiary carboxylic acid amide - Thiazole - Amino acid or derivatives - Carboxamide group - C-nitro compound - Organic nitro compound - Tertiary amine - Tertiary aliphatic amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Thioether - Carboxylic acid derivative - Azacycle - Ether - Organic oxoazanium - Organoheterocyclic compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Organic salt - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as nitrophenyl ethers. These are aromatic compounds containing a nitrobenzene moiety that carries an ether group on the benzene ring.
External Descriptors
Not available