Compound Identification
SMILES
COC(=N)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1C1=CC=C([123I])C=C1)N2C
InChIKey
InChIKey=YPWLHTXXSPYBHZ-LTFFGQHJSA-N
Formula
C16H21IN2O
Mass
380.263
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Tropane alkaloids
- Subclass Phenyltropanes
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Class
Tropane alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Tropane alkaloids
Subclass
Phenyltropanes
Intermediate Tree Nodes
Not available
Direct Parent
Phenyltropanes
Alternative Parents
Phenylpiperidines Piperidinecarboxamides Iodobenzenes Aralkylamines N-alkylpyrrolidines Aryl iodides Trialkylamines Imidoesters Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organoiodides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyltropane - Phenylpiperidine - 3-piperidinecarboxamide - Piperidinecarboxamide - Halobenzene - Iodobenzene - Aralkylamine - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Piperidine - N-alkylpyrrolidine - Benzenoid - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Imido ester - Organoheterocyclic compound - Azacycle - Carboximidic acid derivative - Hydrocarbon derivative - Organohalogen compound - Organic oxygen compound - Organoiodide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenyltropanes. These are compounds containing a phenyl group linked to a tropane moiety. Tropane is an organonitrogenous [3.2.1] bicyclic organic compound.
External Descriptors
Not available