Compound Identification
SMILES
OC1=C(C=C(C=C1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O.CC(=O)CCN1CC(O)C2=CC3=C(OCO3)C=C2C1
InChIKey
InChIKey=ORFXNZHAIDCRKO-UHFFFAOYSA-N
Formula
C20H20N4O11
Mass
492.397
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Tetrahydroisoquinolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Tetrahydroisoquinolines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetrahydroisoquinolines
Alternative Parents
Nitrophenols Benzodioxoles Nitrobenzenes Nitroaromatic compounds Aralkylamines Beta-amino ketones Trialkylamines 1,2-aminoalcohols Secondary alcohols Oxacyclic compounds Organic oxoazanium compounds Acetals Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Nitrophenol - Tetrahydroisoquinoline - Benzodioxole - Nitrobenzene - Nitroaromatic compound - Phenol - Aralkylamine - Monocyclic benzene moiety - Beta-aminoketone - Benzenoid - 1,2-aminoalcohol - Ketone - C-nitro compound - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Acetal - Organic oxoazanium - Oxacycle - Organic oxide - Alcohol - Organic zwitterion - Carbonyl group - Organopnictogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetrahydroisoquinolines. These are tetrahydrogenated isoquinoline derivatives.
External Descriptors
Not available