Compound Identification
SMILES
CC1=C(OCC(O)CNC(C)(C)CNC2=CC=C(C=C2)C2=NNC(=O)CC2)C=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=UAIXVPNWWKCVJW-UHFFFAOYSA-N
Formula
C24H31N5O5
Mass
469.542
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
Nitrobenzenes
- Level 5 Nitrophenyl ethers
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Subclass
Nitrobenzenes
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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
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrophenyl ethers
Alternative Parents
Nitrotoluenes Phenylalkylamines Phenoxy compounds Phenol ethers Nitroaromatic compounds Aniline and substituted anilines Secondary alkylarylamines Pyridazinones Alkyl aryl ethers Secondary alcohols 1,2-aminoalcohols Amino acids and derivatives Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Dialkylamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrophenyl ether - Nitrotoluene - Phenoxy compound - Nitroaromatic compound - Phenol ether - Aniline or substituted anilines - Phenylalkylamine - Toluene - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Pyridazinone - Pyridazine - 1,2-aminoalcohol - C-nitro compound - Secondary alcohol - Amino acid or derivatives - Organic nitro compound - Carboxylic acid derivative - Secondary aliphatic amine - Ether - Organic oxoazanium - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Allyl-type 1,3-dipolar organic compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic salt - Carbonyl group - Organic nitrogen compound - Alcohol - Organic oxygen compound - Organic zwitterion - Aromatic heteromonocyclic 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