Compound Identification
SMILES
COC1=CC=C(CC(=O)NC2=C(C=C3OC(C)(C)[C@H](O)[C@@H](O)C3=C2)[N+]([O-])=O)C=C1
InChIKey
InChIKey=ADJHUPNLXFROKI-RBUKOAKNSA-N
Formula
C20H22N2O7
Mass
402.403
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
Phenylacetamides Phenoxy compounds Anisoles Methoxybenzenes N-arylamides Nitroaromatic compounds Alkyl aryl ethers Secondary carboxylic acid amides Secondary alcohols 1,2-diols Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Carbonyl compounds Organic salts Organic zwitterions Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,2-dimethyl-1-benzopyran - Phenylacetamide - Phenoxy compound - N-arylamide - Phenol ether - Methoxybenzene - Anisole - Nitroaromatic compound - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - C-nitro compound - 1,2-diol - Organic nitro compound - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Oxacycle - Carboxylic acid derivative - Ether - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Organic oxygen compound - Alcohol - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic zwitterion - 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