Compound Identification
SMILES
COC1=C(CC2=CN=C(N)N=C2N)C=C(C=C1)C#CCC(C)C(O)=O
InChIKey
InChIKey=NDQQNVZSDJNYHV-UHFFFAOYSA-N
Formula
C18H20N4O3
Mass
340.383
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenol ethers
- Subclass Anisoles
-
Class
Phenol ethers
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Anisoles
Intermediate Tree Nodes
Not available
Direct Parent
Anisoles
Alternative Parents
Phenoxy compounds Methoxybenzenes Medium-chain fatty acids Alkyl aryl ethers Amino fatty acids Methyl-branched fatty acids Aminopyrimidines and derivatives Heterocyclic fatty acids Unsaturated fatty acids Imidolactams Heteroaromatic compounds Amino acids Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides Carbonyl compounds Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Anisole - Medium-chain fatty acid - Methoxybenzene - Alkyl aryl ether - Amino fatty acid - Aminopyrimidine - Branched fatty acid - Heterocyclic fatty acid - Methyl-branched fatty acid - Monocyclic benzene moiety - Pyrimidine - Unsaturated fatty acid - Fatty acyl - Imidolactam - Fatty acid - Heteroaromatic compound - Amino acid - Amino acid or derivatives - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Amine - Organooxygen compound - Primary amine - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
External Descriptors
Not available