Structure Information
Structure

Compound Identification

SMILES

COC(=O)CC1=C(C(C2=CC(CN3C=C(C=N3)[N+]([O-])=O)=C(OC)C=C2)C(C#N)=C(N)O1)C(=O)OC

InChIKey

InChIKey=NCGMEKLRNFGWTP-UHFFFAOYSA-N

Formula

C22H21N5O8

Mass

483.437

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenol ethers

Subclass

Anisoles

Intermediate Tree Nodes

Not available

Direct Parent

Anisoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenoxy compound - Nitroaromatic compound - Anisole - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Pyran - Azole - Heteroaromatic compound - Pyrazole - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous ester - Carboxylic acid ester - Ketene acetal or derivatives - C-nitro compound - Organic nitro compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Oxacycle - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Ether - Organic oxoazanium - Carbonitrile - Nitrile - Organic salt - Organic oxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Cyanide - Hydrocarbon derivative - Organic zwitterion - Organopnictogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.

External Descriptors

Not available

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