Compound Identification
SMILES
CC1(C)OC2=C(C=C(C=C2)C#N)[C@@H](O)[C@@H]1NC(=O)C1=CC=CC=N1
InChIKey
InChIKey=FMZSLPUUCLLHOT-CVEARBPZSA-N
Formula
C18H17N3O3
Mass
323.352
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzopyrans
-
Subclass
1-benzopyrans
- Level 5 2,2-dimethyl-1-benzopyrans
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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
2,2-dimethyl-1-benzopyrans
Alternative Parents
Pyridinecarboxamides 2-heteroaryl carboxamides Alkyl aryl ethers Benzenoids Heteroaromatic compounds Secondary carboxylic acid amides Secondary alcohols Oxacyclic compounds Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,2-dimethyl-1-benzopyran - Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Alkyl aryl ether - Pyridine - Benzenoid - Heteroaromatic compound - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Nitrile - Carbonitrile - Ether - Carboxylic acid derivative - Oxacycle - Azacycle - Organic nitrogen compound - Organic oxide - Cyanide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Alcohol - Hydrocarbon derivative - 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