Compound Identification
SMILES
COC1=CC=CC=C1N1CCN(CCN2C(C3=C(C=C(I)C=C3)C2=O)C2=CC=CC=C2)CC1
InChIKey
InChIKey=JYECURKTQIXZMD-UHFFFAOYSA-N
Formula
C27H28IN3O2
Mass
553.444
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazinanes
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Subclass
Piperazines
- Level 5 Phenylpiperazines
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Subclass
Piperazines
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Class
Diazinanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpiperazines
Alternative Parents
N-arylpiperazines Isoindolones Aminophenyl ethers Methoxyanilines Isoindoles Phenoxy compounds Methoxybenzenes Anisoles Dialkylarylamines Alkyl aryl ethers N-alkylpiperazines Aryl iodides Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organoiodides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpiperazine - N-arylpiperazine - Isoindolone - Isoindoline - Isoindole - Aminophenyl ether - Isoindole or derivatives - Methoxyaniline - Anisole - Phenoxy compound - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - N-alkylpiperazine - Aryl iodide - Aryl halide - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Lactam - Carboxamide group - Azacycle - Carboxylic acid derivative - Ether - Organic oxide - Organic nitrogen compound - Amine - Organic oxygen compound - Organopnictogen compound - Organohalogen compound - Hydrocarbon derivative - Organoiodide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl group.
External Descriptors
Not available