Compound Identification
SMILES
COC1=CC(OC)=CC(CN2[C@H](CC3=CC=CC=C3)[C@@H]3OC(C)(C)O[C@H]3[C@@H](CC3=CC=CC=C3)N(CC3=CC=CC(=C3)C(=O)NC3=NC=CN=C3)C2=O)=C1
InChIKey
InChIKey=LBFSHIVUVQBUAT-QQGWDPLKSA-N
Formula
C43H45N5O6
Mass
727.862
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
Benzamides Anisoles Phenoxy compounds Benzoyl derivatives 1,3-diazepanes Alkyl aryl ethers Ketals Pyrazines Imidolactams 1,3-dioxolanes Heteroaromatic compounds Ureas Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
M-dimethoxybenzene - Dimethoxybenzene - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Anisole - Benzoyl - Phenol ether - 1,3-diazepane - Alkyl aryl ether - Ketal - Diazepane - Pyrazine - Imidolactam - Meta-dioxolane - Heteroaromatic compound - Urea - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Acetal - Ether - Oxacycle - Carboxylic acid derivative - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - 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