Compound Identification
SMILES
COC1=CC=C(C[C@@H](C)NC[C@H](O)C2=CC(=C(OCC3=CC=CC=C3)C=C2)[N+]([O-])=O)C=C1
InChIKey
InChIKey=RMHXNBJFUYQJMD-KOSHJBKYSA-N
Formula
C25H28N2O5
Mass
436.508
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
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
Amphetamines and derivatives Phenylpropanes Anisoles Phenoxy compounds Methoxybenzenes Nitroaromatic compounds Alkyl aryl ethers Aralkylamines 1,2-aminoalcohols Secondary alcohols Dialkylamines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic salts Organic zwitterions Hydrocarbon derivatives Aromatic alcohols Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrophenyl ether - Amphetamine or derivatives - Phenylpropane - Phenoxy compound - Nitroaromatic compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Aralkylamine - 1,2-aminoalcohol - Organic nitro compound - C-nitro compound - Secondary alcohol - Secondary aliphatic amine - Ether - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organonitrogen compound - Organic oxygen compound - Organic salt - Alcohol - Organic nitrogen compound - Organooxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Aromatic alcohol - Organic zwitterion - Aromatic homomonocyclic 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