Compound Identification
SMILES
COC1=C(NN=C2C(=O)C3=C(C=CC(NC4=CC=CC=C4)=C3)C=C2S(O)(=O)=O)C=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=QUMJMMDJTMEBSW-UHFFFAOYSA-N
Formula
C23H18N4O7S
Mass
494.48
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
Naphthalenes Methoxyanilines Anisoles Aryl ketones Methoxybenzenes Nitroaromatic compounds Phenoxy compounds Phenylhydrazines Alkyl aryl ethers Primary aromatic amines Organosulfonic acids Sulfonyls Organic oxoazanium compounds Hydrazones Secondary amines Propargyl-type 1,3-dipolar organic compounds Organic salts Organic oxides Organic zwitterions Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Nitrophenyl ether - Naphthalene - Methoxyaniline - Phenoxy compound - Nitroaromatic compound - Anisole - Phenol ether - Phenylhydrazine - Methoxybenzene - Aniline or substituted anilines - Aryl ketone - Alkyl aryl ether - Primary aromatic amine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Organic nitro compound - Ketone - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Ether - Secondary amine - Hydrazone - Organic oxoazanium - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic nitrogen compound - Organic zwitterion - Amine - Aromatic homopolycyclic 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