Compound Identification
SMILES
CN1N(C(=O)C(N\C=C2\C(=O)N(CC3=CC=CO3)C(=O)C3=CC=CC=C23)=C1C)C1=CC=CC=C1
InChIKey
InChIKey=SPUYWBRASNCZCJ-PXLXIMEGSA-N
Formula
C26H22N4O4
Mass
454.486
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 Secondary alkylarylamines Benzene and substituted derivatives Pyrazolones N-substituted carboxylic acid imides Vinylogous amides Dicarboximides Furans Heteroaromatic compounds Amino acids and derivatives Lactams Enamines Azacyclic compounds Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-isoquinolinedione - Isoquinolone - Phenylpyrazole - Tetrahydroisoquinoline - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Pyrazolinone - Benzenoid - Azole - Carboxylic acid imide - Dicarboximide - Furan - Heteroaromatic compound - Pyrazole - Vinylogous amide - Lactam - Amino acid or derivatives - Enamine - Carboxylic acid derivative - Oxacycle - Azacycle - Secondary amine - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - 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