Compound Identification
SMILES
COCOC1=C2[C@H]3C4CC5=C([C@H](CN)N4C(C#N)[C@H](CC2=CC(C)=C1OC)N3C)C1=C(COO1)C(C)=C5OCC=C
InChIKey
InChIKey=DPQSDBKQMCZXQM-PTFOZODISA-N
Formula
C31H38N4O6
Mass
562.667
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzazocines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzazocines
Intermediate Tree Nodes
Not available
Direct Parent
Benzazocines
Alternative Parents
Tetrahydroisoquinolines Anisoles N-methylpiperazines Aralkylamines Alkyl aryl ethers Trialkylamines Alpha-aminonitriles Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazocine - Tetrahydroisoquinoline - Anisole - Alkyl aryl ether - Aralkylamine - N-methylpiperazine - N-alkylpiperazine - 1,4-diazinane - Piperazine - Alpha-aminonitrile - Tertiary amine - Tertiary aliphatic amine - Acetal - Ether - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organic oxygen compound - Amine - Primary aliphatic amine - Organooxygen compound - Cyanide - Primary amine - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzazocines. These are organic compounds containing the benzazocine ring system, which consists of a benzene ring bound to an azocine ring.
External Descriptors
Not available