Compound Identification
SMILES
COC1=C(OC)C=C(C(C[N+]2=CSC(CCOC(=O)CCCCC(=O)OCCC3=C(C)[N+](CC4=CC(OC)=C(OC)C=C4[N+]([O-])=O)=CS3)=C2C)=C1)[N+]([O-])=O
InChIKey
InChIKey=QUDLVMLMASFTLL-UHFFFAOYSA-N
Formula
C36H44N4O12S2
Mass
788.88
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
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
Dimethoxybenzenes Methoxyanilines Phenoxy compounds Anisoles Nitroaromatic compounds 4,5-disubstituted thiazoles Alkyl aryl ethers Fatty acid esters Dicarboxylic acids and derivatives Heteroaromatic compounds Carboxylic acid esters Organic oxoazanium compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrophenyl ether - Dimethoxybenzene - O-dimethoxybenzene - Methoxyaniline - Phenol ether - Phenoxy compound - Nitroaromatic compound - Anisole - Methoxybenzene - 4,5-disubstituted 1,3-thiazole - Alkyl aryl ether - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Azole - Thiazole - Heteroaromatic compound - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Organic oxoazanium - Ether - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic salt - Organic cation - 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