Structure Information
Structure

Compound Identification

SMILES

CCC[C@](S)(CC(O)=O)OC(=O)C1=C(C)NC(C)=C([C@H]1C1=CC=CC=C1OCC1=CC=CC=C1)[N+]([O-])=O

InChIKey

InChIKey=WMMXWWCNNFXEBC-IGKIAQTJSA-N

Formula

C27H30N2O7S

Mass

526.6

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenol ethers

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenol ethers

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenoxy compound - Phenol ether - Medium-chain fatty acid - Alkyl aryl ether - Dihydropyridine - Heterocyclic fatty acid - Thia fatty acid - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Hydropyridine - Fatty acyl - Vinylogous amide - Enoate ester - Alpha,beta-unsaturated carboxylic ester - C-nitro compound - Carboxylic acid ester - Organic nitro compound - Amino acid - Amino acid or derivatives - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Ether - Carboxylic acid derivative - Enamine - Organic oxoazanium - Alkylthiol - Azacycle - Carboxylic acid - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Amine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.

External Descriptors

Not available

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