Compound Identification
SMILES
COC1=CC=C(C=C1)C1=NOC(=N1)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1C1=CC=C(Cl)C=C1)N2C
InChIKey
InChIKey=UHKLODIEZLNQLP-KCLUMXDGSA-N
Formula
C23H24ClN3O2
Mass
409.91
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 Phenyloxadiazoles Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Chlorobenzenes Aralkylamines N-alkylpyrrolidines Aryl chlorides Heteroaromatic compounds Trialkylamines Azacyclic compounds Oxacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyltropane - Phenylpiperidine - Phenyl-1,2,4-oxadiazole - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aralkylamine - Benzenoid - N-alkylpyrrolidine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperidine - Azole - Pyrrolidine - 1,2,4-oxadiazole - Oxadiazole - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - 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