Compound Identification
SMILES
COC1=CC2=C(C=C1)\C(=C/NC1=C(C)N(C)N(C1=O)C1=CC=CC=C1)C(=O)NC2=O
InChIKey
InChIKey=GBRQSDMIEJXBQO-LDADJPATSA-N
Formula
C22H20N4O4
Mass
404.426
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Isoquinolines and derivatives
- Subclass 1,3-isoquinolinediones
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Class
Isoquinolines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
1,3-isoquinolinediones
Intermediate Tree Nodes
Not available
Direct Parent
1,3-isoquinolinediones
Alternative Parents
Phenylpyrazoles Isoquinolones and derivatives Tetrahydroisoquinolines Anisoles Alkyl aryl ethers Pyrazolones Benzene and substituted derivatives Vinylogous amides N-unsubstituted carboxylic acid imides Heteroaromatic compounds Dicarboximides Lactams Enamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-isoquinolinedione - Isoquinolone - Phenylpyrazole - Tetrahydroisoquinoline - Anisole - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Pyrazolinone - Azole - Carboxylic acid imide - Dicarboximide - Heteroaromatic compound - Carboxylic acid imide, n-unsubstituted - Vinylogous amide - Pyrazole - Lactam - Ether - Enamine - Carboxylic acid derivative - Azacycle - Organic oxide - Amine - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,3-isoquinolinediones. These are isoquinoline derivatives carrying one C=O group at positions 1, and 3 respectively.
External Descriptors
Not available