Structure Information
Structure

Compound Identification

SMILES

Cl.[O-][N+](=O)O[C@H]1CO[C@@H]2[C@H](CO[C@H]12)NCC1=CC=CC=C1

InChIKey

InChIKey=AFLQLUJAGMFJSO-WZQXUVPTSA-N

Formula

C13H17ClN2O5

Mass

316.74

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Furofurans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Furofurans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzylamine - Furofuran - Phenylmethylamine - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Organic nitrate - Oxolane - Alkyl nitrate - Organic nitro compound - Organic nitric acid or derivatives - Oxacycle - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Dialkyl ether - Secondary aliphatic amine - Secondary amine - Ether - Organic salt - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Hydrochloride - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as furofurans. These are organic compounds containing a two furan rings fused to each other. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom.

External Descriptors

Not available

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