Compound Identification
SMILES
COC1=C(C)C2=C(C=C1C#CC1=CC=CC=C1)C(OS(=O)(=O)C1=CC=C(C)C=C1)=C(NC(=O)C1=CC3=C(OC(C)(C)CC3)C=C1)C(=O)O2
InChIKey
InChIKey=TUOYBBZZJXDRHM-UHFFFAOYSA-N
Formula
C38H33NO8S
Mass
663.74
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
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Subclass
1-benzopyrans
- Level 5 2,2-dimethyl-1-benzopyrans
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Subclass
1-benzopyrans
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Class
Benzopyrans
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Not available
Direct Parent
2,2-dimethyl-1-benzopyrans
Alternative Parents
p-Methylbenzenesulfonates Benzenesulfonate esters Coumarins and derivatives Tosyl compounds Arylsulfonic acids and derivatives Benzenesulfonyl compounds Anisoles Alkyl aryl ethers Pyranones and derivatives Organosulfonic acid esters Heteroaromatic compounds Sulfonyls Lactones Secondary carboxylic acid amides Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,2-dimethyl-1-benzopyran - P-methylbenzenesulfonate - Benzenesulfonate ester - Coumarin - Benzenesulfonate - Tosyl compound - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Anisole - Phenol ether - Alkyl aryl ether - Toluene - Pyranone - Benzenoid - Organosulfonic acid ester - Pyran - Monocyclic benzene moiety - Heteroaromatic compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Lactone - Carboxamide group - Secondary carboxylic acid amide - Oxacycle - Ether - Carboxylic acid derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2,2-dimethyl-1-benzopyrans. These are organic compounds containing a 1-benzopyran moiety that carries two methyl groups at the 2-position.
External Descriptors
Not available