Compound Identification
SMILES
COC1=C(O)C(=C(CN2CCC[C@@H]2[C@H](O)CNC(C)(C)CC2=CC3=CC=CC=C3C=C2)C=C1)[N+]([O-])=O
InChIKey
InChIKey=RUHZUCVBOQWESA-DNQXCXABSA-N
Formula
C28H35N3O5
Mass
493.604
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
Nitrophenols Naphthalenes Methoxyphenols Methoxyanilines Anisoles Phenylmethylamines Phenoxy compounds Benzylamines Methoxybenzenes Nitroaromatic compounds 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Aralkylamines N-alkylpyrrolidines Secondary alcohols Trialkylamines 1,2-aminoalcohols Organic oxoazanium compounds Dialkylamines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrophenyl ether - Nitrophenol - Naphthalene - Methoxyphenol - Methoxyaniline - Phenylmethylamine - Phenol ether - Methoxybenzene - Phenoxy compound - Nitroaromatic compound - Benzylamine - Anisole - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Aralkylamine - Alkyl aryl ether - N-alkylpyrrolidine - Pyrrolidine - 1,2-aminoalcohol - C-nitro compound - Organic nitro compound - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Organic oxoazanium - Ether - Azacycle - Organic zwitterion - Alcohol - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Amine - Organooxygen compound - Organic oxygen compound - Organic salt - 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