Compound Identification
SMILES
COC1=C(OCC2=CC=CC=C2)C=C2CCN=C(C(=O)C3=CC=CC=C3OS(=O)(=O)C3=CC=C(C)C=C3)C2=C1
InChIKey
InChIKey=RRFRQSCNUCIUCX-UHFFFAOYSA-N
Formula
C31H27NO6S
Mass
541.62
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoquinolines and derivatives
- Subclass Benzylisoquinolines
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Class
Isoquinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Benzylisoquinolines
Intermediate Tree Nodes
Not available
Direct Parent
Benzylisoquinolines
Alternative Parents
p-Methylbenzenesulfonates Benzenesulfonate esters Tosyl compounds Dihydroisoquinolines Arylsulfonic acids and derivatives Benzenesulfonyl compounds Phenoxy compounds Anisoles Aryl ketones Benzoyl derivatives Alkyl aryl ethers Organosulfonic acid esters Sulfonyls Ketimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzylisoquinoline - P-methylbenzenesulfonate - Benzenesulfonate ester - Benzenesulfonate - Tosyl compound - Dihydroisoquinoline - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Benzoyl - Phenoxy compound - Aryl ketone - Anisole - Alkyl aryl ether - Toluene - Benzenoid - Organosulfonic acid ester - Monocyclic benzene moiety - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Ketimine - Ketone - Azacycle - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Imine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organosulfur compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzylisoquinolines. These are organic compounds containing an isoquinoline to which a benzyl group is attached.
External Descriptors
Not available