Structure Information
Structure

Compound Identification

SMILES

O=C(CC1(C(=O)OC2=CC=CC=C12)C1=CC=CC=C1)N1CCN(CC2=CC3=C(OCO3)C=C2)CC1

InChIKey

InChIKey=XNIFFRFEKJQGBJ-UHFFFAOYSA-N

Formula

C28H26N2O5

Mass

470.525

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Coumarans

Subclass

1-phenylcoumarans

Intermediate Tree Nodes

Not available

Direct Parent

1-phenylcoumarans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-phenylcoumaran - Benzofuran - Benzodioxole - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Benzenoid - Piperazine - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Lactone - Amino acid or derivatives - Acetal - Oxacycle - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-phenylcoumarans. These are compounds containing a coumaran ring system substituted at the 1-position with phenyl group.

External Descriptors

Not available

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