Compound Identification
SMILES
C[C@@H]1C2CC3=C(C=C(O)C=C3)[C@]1(C)CC[N+]2([O-])CC=C(C)C
InChIKey
InChIKey=HWJKJDJXDLXWAS-VVXDDCKHSA-N
Formula
C19H27NO2
Mass
301.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
6,7-benzomorphans
- Subclass 2,6-dimethyl-3-benzazocines
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Class
6,7-benzomorphans
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
6,7-benzomorphans
Subclass
2,6-dimethyl-3-benzazocines
Intermediate Tree Nodes
Not available
Direct Parent
2,6-dimethyl-3-benzazocines
Alternative Parents
4-hydroxy-6,7-benzomorphans Benzazocines Tetralins 1-hydroxy-2-unsubstituted benzenoids Piperidines Trialkyl amine oxides Trisubstituted amine oxides and derivatives Azacyclic compounds Organooxygen compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,6-dimethyl-3-benzazocine - 4-hydroxy-6,7-benzomorphan - Benzazocine - Tetralin - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Piperidine - Benzenoid - Trialkyl amine oxide - N-oxide - Trisubstituted n-oxide - Organoheterocyclic compound - Azacycle - Organic zwitterion - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2,6-dimethyl-3-benzazocines. These are aromatic compounds containing a 6,7-benzomorphan skeleton, which is substituted by methyl group at the 2- and 6-positions.
External Descriptors
Not available