Compound Identification
SMILES
COC1=CC(=C(C=C1)C1=NC(=CCC2CC3=C(Cl)C=CC(OC)=C3C3(C2)OCCO3)C(=O)O1)[N+]([O-])=O
InChIKey
InChIKey=MMICGSZMXZALQU-UHFFFAOYSA-N
Formula
C25H23ClN2O8
Mass
514.92
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
Tetralins Alpha amino acids and derivatives Methoxyanilines Phenoxy compounds Anisoles Methoxybenzenes Nitroaromatic compounds 4-Hydrocarbylideneazlactones Alkyl aryl ethers Ketals Aryl chlorides 1,3-dioxolanes Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Carbonyl compounds Organopnictogen compounds Organic salts Hydrocarbon derivatives Organonitrogen compounds Organic oxides Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrophenyl ether - Tetralin - Alpha-amino acid or derivatives - Methoxyaniline - Phenoxy compound - Nitroaromatic compound - Phenol ether - Anisole - Methoxybenzene - Alkyl aryl ether - Ketal - 4-hydrocarbylideneazlactone - Aryl halide - Aryl chloride - Oxazoline - Meta-dioxolane - Organic nitro compound - C-nitro compound - Acetal - Oxacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic salt - Carbonyl group - Organic oxygen compound - Organopnictogen compound - 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