Compound Identification
SMILES
COC1=CC(OC)=C(Cl)C=C1CCC1(CC(=O)C(SC2=NC=C(CO)N2C)C(=O)O1)C1CCCC1
InChIKey
InChIKey=CZUBRLAHDBAYCL-UHFFFAOYSA-N
Formula
C25H31ClN2O6S
Mass
523.04
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Methoxybenzenes
- Level 5 Dimethoxybenzenes
-
Subclass
Methoxybenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Methoxybenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Dimethoxybenzenes
Alternative Parents
1,2,5-trisubstituted imidazoles Phenoxy compounds Anisoles Alkyl aryl ethers Alkylarylthioethers Chlorobenzenes Delta valerolactones 1,3-dicarbonyl compounds Oxanes Aryl chlorides N-substituted imidazoles Heteroaromatic compounds Cyclic ketones Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organic oxides Aromatic alcohols Organochlorides Organonitrogen compounds Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
M-dimethoxybenzene - Dimethoxybenzene - 1,2,5-trisubstituted-imidazole - Phenoxy compound - Aryl thioether - Anisole - Trisubstituted imidazole - Phenol ether - Alkyl aryl ether - Halobenzene - Delta valerolactone - Delta_valerolactone - Chlorobenzene - Alkylarylthioether - 1,3-dicarbonyl compound - Oxane - Aryl halide - N-substituted imidazole - Aryl chloride - Heteroaromatic compound - Azole - Imidazole - Ketone - Carboxylic acid ester - Cyclic ketone - Lactone - Oxacycle - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Sulfenyl compound - Ether - Thioether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Aromatic alcohol - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Primary alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Alcohol - Organochloride - Organohalogen compound - Aromatic heteromonocyclic 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