Compound Identification
SMILES
CN(CCNC1=C2C=CC=C3C(=O)N(CCCCCOC4CCCCO4)C(=O)C(C=C1)=C23)CC1=CC=CC=C1B(O)O
InChIKey
InChIKey=QQVNVEUYTFMXDL-UHFFFAOYSA-N
Formula
C32H40BN3O6
Mass
573.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoquinolines and derivatives
- Subclass Isoquinolones and derivatives
-
Class
Isoquinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Isoquinolones and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Isoquinolones and derivatives
Alternative Parents
Naphthalenes Phenylmethylamines Benzylamines Secondary alkylarylamines Aralkylamines Oxanes N-substituted carboxylic acid imides Trialkylamines Amino acids and derivatives Boronic acids Acetals Oxacyclic compounds Azacyclic compounds Organic metalloid salts Organometalloid compounds Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Naphthalene - Benzylamine - Phenylmethylamine - Aralkylamine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - Oxane - Carboxylic acid imide - Amino acid or derivatives - Boronic acid derivative - Boronic acid - Tertiary aliphatic amine - Tertiary amine - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Organic metalloid salt - Secondary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organopnictogen compound - Organic metalloid moeity - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoquinolones and derivatives. These are aromatic polycyclic compounds containing a ketone bearing isoquinoline moiety.
External Descriptors
Not available