Compound Identification
SMILES
COC1=C(OC[C@H](O)C[NH+]2CCCC2)C=C(CNCCC2=NC=CN=C2)C=C1
InChIKey
InChIKey=BNFDQSYANADYJY-LJQANCHMSA-O
Formula
C21H31N4O3
Mass
387.503
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylmethylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylmethylamines
Alternative Parents
Phenoxy compounds Methoxybenzenes Anisoles Benzylamines Alkyl aryl ethers Aralkylamines Pyrazines N-alkylpyrrolidines Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Secondary alcohols 1,2-aminoalcohols Dialkylamines Azacyclic compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Anisole - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Pyrazine - N-alkylpyrrolidine - Heteroaromatic compound - Pyrrolidine - Quaternary ammonium salt - Secondary alcohol - Tertiary aliphatic amine - 1,2-aminoalcohol - Secondary amine - Secondary aliphatic amine - Ether - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Alcohol - Amine - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
External Descriptors
Not available