Compound Identification
SMILES
COC1=CC(OC)=C(CN2CCN(C)CC2)C(O)=C1C(=O)C1=CC=CC=C1Br
InChIKey
InChIKey=RVLHOTVUKMRJNN-UHFFFAOYSA-N
Formula
C21H25BrN2O4
Mass
449.345
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazinanes
-
Subclass
Piperazines
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Level 5
N-alkylpiperazines
- Level 6 N-methylpiperazines
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Level 5
N-alkylpiperazines
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Subclass
Piperazines
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Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
N-alkylpiperazines - N-methylpiperazines
Direct Parent
Dimethoxybenzyl-N-methylpiperazines
Alternative Parents
Benzophenones Aryl-phenylketones Diphenylmethanes Dimethoxybenzenes Methoxyphenols Phenylmethylamines Phenoxy compounds Anisoles Benzylamines Benzoyl derivatives Alkyl aryl ethers Aralkylamines 1-hydroxy-4-unsubstituted benzenoids Bromobenzenes Aryl bromides Vinylogous halides Vinylogous acids Trialkylamines Azacyclic compounds Organobromides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dimethoxybenzyl-n-methylpiperazine - Benzophenone - Aryl-phenylketone - Diphenylmethane - Methoxyphenol - M-dimethoxybenzene - Dimethoxybenzene - Anisole - Phenoxy compound - Benzoyl - Benzylamine - Methoxybenzene - Phenol ether - Phenylmethylamine - Aryl ketone - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Bromobenzene - Halobenzene - Aralkylamine - Phenol - Aryl bromide - Benzenoid - Aryl halide - Monocyclic benzene moiety - Vinylogous halide - Vinylogous acid - Tertiary aliphatic amine - Tertiary amine - Ketone - Azacycle - Ether - Organic oxide - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Organohalogen compound - Organobromide - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as dimethoxybenzyl-n-methylpiperazines. These are organic aromatic compounds containing a piperazine ring that carries a methyl group on one amine group and a dimethoxybenzyl moiety on the other amine group.
External Descriptors
Not available