Compound Identification
SMILES
OC(=O)C(O)=O.OC(=O)C(O)=O.NCCC1CC2=CC=CC=C2C(=N1)C1=CC=CC=C1F
InChIKey
InChIKey=BGVKBWCHPRTPNO-UHFFFAOYSA-N
Formula
C21H21FN2O8
Mass
448.403
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Dihydroisoquinolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Dihydroisoquinolines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Dihydroisoquinolines
Alternative Parents
Fluorobenzenes Aralkylamines Dicarboxylic acids and derivatives Aryl fluorides Ketimines Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Azacyclic compounds Organofluorides Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Dihydroisoquinoline - Aralkylamine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Ketimine - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Primary amine - Imine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Carbonyl group - Primary aliphatic amine - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dihydroisoquinolines. These are isoquinoline derivatives where exactly two carbon atoms joined by an aromatic bond are linked with a hydrogen atom each, resulting in a CC single bond.
External Descriptors
Not available