Compound Identification
SMILES
CN([C@@H]1[C@@H](O)C(C)(C)OC2=C1C=C(C=C2)C#N)C1=CC(=O)OC1
InChIKey
InChIKey=ZPSSNQYYTZTQRV-JKSUJKDBSA-N
Formula
C17H18N2O4
Mass
314.341
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
-
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
Alkyl aryl ethers Aralkylamines Butenolides Benzenoids Vinylogous amides Enoate esters Trialkylamines Secondary alcohols 1,2-aminoalcohols Lactones Amino acids and derivatives Oxacyclic compounds Nitriles Monocarboxylic acids and derivatives Enamines Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,2-dimethyl-1-benzopyran - Alkyl aryl ether - Aralkylamine - 2-furanone - Benzenoid - Dihydrofuran - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - 1,2-aminoalcohol - Amino acid or derivatives - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Lactone - Carboxylic acid derivative - Oxacycle - Enamine - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Alcohol - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Amine - Organooxygen compound - Cyanide - Organic oxide - Organonitrogen compound - 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