Compound Identification
SMILES
COC1=C(OC)C=C(C(CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)=C1)S(=O)(=O)N1CCN(CC2=CC=CC=C2)CC1
InChIKey
InChIKey=JNJXWJJLGZYDMR-UHFFFAOYSA-N
Formula
C33H33N3O6S
Mass
599.7
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Isoquinolines and derivatives
- Subclass Isoquinolones and derivatives
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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
Isoquinolones and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Isoquinolones and derivatives
Alternative Parents
Benzenesulfonamides Naphthalenes Dimethoxybenzenes Benzenesulfonyl compounds Anisoles Phenylmethylamines Phenoxy compounds Benzylamines Aralkylamines Alkyl aryl ethers N-alkylpiperazines Organosulfonamides N-substituted carboxylic acid imides Sulfonyls Trialkylamines Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Benzenesulfonamide - O-dimethoxybenzene - Dimethoxybenzene - Naphthalene - Benzenesulfonyl group - Phenoxy compound - Anisole - Benzylamine - Methoxybenzene - Phenol ether - Phenylmethylamine - Alkyl aryl ether - Aralkylamine - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Carboxylic acid imide, n-substituted - Benzenoid - Piperazine - Organosulfonic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid imide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Ether - Carboxylic acid derivative - Azacycle - Amine - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen 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