Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C1=NN2C(C)=NC(C)=C2C(NC2=CC=CC=C2Br)=N1
InChIKey
InChIKey=NCOUWLJIIRWSNG-UHFFFAOYSA-N
Formula
C21H20BrN5O2
Mass
454.328
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Methoxybenzenes
- Level 5 Dimethoxybenzenes
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Subclass
Methoxybenzenes
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Methoxybenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Dimethoxybenzenes
Alternative Parents
Phenoxy compounds Anisoles Aniline and substituted anilines Bromobenzenes Alkyl aryl ethers N-substituted imidazoles Imidolactams Aryl bromides 1,2,4-triazines Heteroaromatic compounds Secondary amines Azacyclic compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
O-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - N-substituted imidazole - Triazine - Imidolactam - 1,2,4-triazine - Imidazole - Heteroaromatic compound - Azole - Ether - Azacycle - Secondary amine - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.
External Descriptors
Not available