Structure Information
Structure

Compound Identification

SMILES

CN1CC(COC(=O)N(CCCl)N=O)=CC2C1CC1=CN(N=O)C3=CC=CC2=C13

InChIKey

InChIKey=PWZOBKHIWOXKDT-UHFFFAOYSA-N

Formula

C19H20ClN5O4

Mass

417.85

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Ergoline and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Ergoline and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Ergoline skeleton - Benzoquinoline - Pyrroloquinoline - Quinoline - 3-alkylindole - Indole - Indole or derivatives - Isoindole or derivatives - Aralkylamine - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Nitrosamide - Pyrrole - Organic nitrosamine - Tertiary aliphatic amine - Tertiary amine - Organic n-nitroso compound - Carbonic acid derivative - Azacycle - Organoheterocyclic compound - Organic nitroso compound - Alkyl halide - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Amine - Alkyl chloride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as ergoline and derivatives. These are compounds containing an ergoline moiety, which is structurally characterized by he presence of a 4,6,6a,7,8,9,10,10a-octahydroindolo[4,3-fg] quinoline.

External Descriptors

Not available

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