Compound Identification
SMILES
COCC1(COC)OC2=C(C=C(C=C2)C#N)[C@@H](NC2=NN(C(C)C)C(=O)C=C2)[C@@H]1O
InChIKey
InChIKey=QOLCGWGDYZGHQO-UXHICEINSA-N
Formula
C21H26N4O5
Mass
414.462
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
- 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
1-benzopyrans
Alternative Parents
Pyridazinones Aminopyridazines Alkyl aryl ethers Imidolactams Benzenoids Heteroaromatic compounds Secondary alcohols Lactams Oxacyclic compounds Nitriles Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzopyran - Alkyl aryl ether - Aminopyridazine - Pyridazinone - Pyridazine - Imidolactam - Benzenoid - Heteroaromatic compound - Lactam - Secondary alcohol - Dialkyl ether - Ether - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organic oxygen compound - Amine - Cyanide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Alcohol - 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