Structure Information
Structure

Compound Identification

SMILES

[O-]C1=C(C=C(C=C1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O.O=C1CC([NH2+]C(C1CC1=CC=CC=C1)C1=CC=CO1)C1=CC=CO1

InChIKey

InChIKey=HFKUQRCPGHKABQ-UHFFFAOYSA-N

Formula

C26H22N4O10

Mass

550.48

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Piperidines

Subclass

Benzylpiperidines

Intermediate Tree Nodes

Not available

Direct Parent

3-benzylpiperidines

Alternative Parents

Nitrobenzenes Nitroaromatic compounds Aralkylamines Piperidinones Phenoxides Quaternary ammonium salts Furans Heteroaromatic compounds Cyclic ketones Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Oxacyclic compounds Dialkylamines Organic oxoazanium compounds Organic salts Hydrocarbon derivatives Organic zwitterions Organic oxides

Molecular Framework

Not available

Substituents

3-benzylpiperidine - Nitrobenzene - Nitroaromatic compound - Phenoxide - Piperidinone - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Furan - Heteroaromatic compound - Quaternary ammonium salt - Ketone - C-nitro compound - Organic nitro compound - Cyclic ketone - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary aliphatic amine - Organic oxoazanium - Oxacycle - Azacycle - Organonitrogen compound - Organic salt - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Organic zwitterion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 3-benzylpiperidines. These are organic compounds containing a benzyl group attached to the 3-position of a piperidine.

External Descriptors

Not available

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