Compound Identification
SMILES
COC1=CC=C(C=C1)C(=O)SC1=CC2=C(CC3[C@H](C)[C@@]2(C)CCN3C)C=C1
InChIKey
InChIKey=RYRZMIGHTQNOPF-NPOUZMSNSA-N
Formula
C23H27NO2S
Mass
381.53
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
Benzazocines Tetralins Thiobenzoic acids and derivatives Benzoic acids and derivatives Phenoxy compounds Methoxybenzenes Anisoles Benzoyl derivatives Aryl thioethers Alkyl aryl ethers Aralkylamines Piperidines Trialkylamines Thioesters Amino acids and derivatives Carbothioic S-esters Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,6-dimethyl-3-benzazocine - Benzazocine - Tetralin - Benzoic acid or derivatives - Thiobenzoic acid or derivatives - Phenoxy compound - Aryl thioether - Anisole - Benzoyl - Methoxybenzene - Phenol ether - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Piperidine - Benzenoid - Amino acid or derivatives - Carbothioic s-ester - Tertiary amine - Thiocarboxylic acid ester - Tertiary aliphatic amine - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Thiocarboxylic acid or derivatives - Amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen 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