Compound Identification
SMILES
COC1=C(C)C(=O)C2=C([C@@H]3CN(C)C(=O)[C@@](C2)(OC(C)=O)N3C)C1=N
InChIKey
InChIKey=HOGYOBYWTVNPEG-APPDUMDISA-N
Formula
C17H21N3O5
Mass
347.371
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
Alpha amino acids and derivatives P-quinonimines N-methylpiperazines Vinylogous esters Tertiary carboxylic acid amides Lactams Ketones Ketimines Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Isoquinolone - Alpha-amino acid or derivatives - P-quinonimine - Quinonimine - N-methylpiperazine - N-alkylpiperazine - Piperazine - 1,4-diazinane - Vinylogous ester - Tertiary carboxylic acid amide - Lactam - Ketone - Carboxylic acid ester - Carboxamide group - Ketimine - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Imine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Aliphatic 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