Compound Identification
SMILES
COC1=CC=C\C(=C\NNC(=O)C2=CC=C(COC3=C(C=C(C)C=C3)[N+]([O-])=O)O2)C1=O
InChIKey
InChIKey=GXRDAHWSDHFWIA-KAMYIIQDSA-N
Formula
C21H19N3O7
Mass
425.397
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
Nitrotoluenes Phenoxy compounds Phenol ethers Furoic acid and derivatives Nitroaromatic compounds O-quinomethanes Alkyl aryl ethers Vinylogous amides Heteroaromatic compounds Carboxylic acid hydrazides Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Organic zwitterions Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Organic salts Aldehydes Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrophenyl ether - Nitrotoluene - Furoic acid or derivatives - Phenoxy compound - Nitroaromatic compound - O-quinomethane - Phenol ether - Quinomethane - Alkyl aryl ether - Toluene - Furan - Heteroaromatic compound - Vinylogous amide - Carboxylic acid hydrazide - Ketone - C-nitro compound - Cyclic ketone - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Organic oxoazanium - Organic zwitterion - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Aldehyde - Organic oxide - Hydrocarbon derivative - Organic salt - Carbonyl group - 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