Compound Identification
SMILES
COCC1(COC)OC2=C(C=C(C=C2)C#N)[C@@H](NC(=O)C2=CC=CC=C2)[C@@H]1O
InChIKey
InChIKey=PCKVGJWLLVIKGS-MOPGFXCFSA-N
Formula
C21H22N2O5
Mass
382.416
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
- Subclass 1-benzopyrans
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Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Not available
Direct Parent
1-benzopyrans
Alternative Parents
Benzamides Benzoyl derivatives Alkyl aryl ethers Secondary carboxylic acid amides Secondary alcohols Oxacyclic compounds Nitriles Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzopyran - Benzamide - Benzoic acid or derivatives - Benzoyl - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Oxacycle - Carboxylic acid derivative - Nitrile - Carbonitrile - Ether - Dialkyl ether - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxide - Cyanide - Alcohol - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.
External Descriptors
Not available