Compound Identification
SMILES
CN[C@@H](C)[C@@H](O)C1=CC=CC=C1.CC(C)CC1=CC=C(C=C1)C(C)C(O)=O.CN(C)CCC(C1=CC=C(Cl)C=C1)C1=CC=CC=N1
InChIKey
InChIKey=XVXGWWOWCFLBRO-WGZMRZIQSA-N
Formula
C39H52ClN3O3
Mass
646.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
- Subclass Pheniramines
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Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pheniramines
Intermediate Tree Nodes
Not available
Direct Parent
Pheniramines
Alternative Parents
Phenylpropanoic acids Monocyclic monoterpenoids Aromatic monoterpenoids Phenylpropanes Aralkylamines Chlorobenzenes Aryl chlorides Heteroaromatic compounds Trialkylamines Secondary alcohols 1,2-aminoalcohols Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Dialkylamines Hydrocarbon derivatives Organic oxides Carbonyl compounds Aromatic alcohols Organochlorides
Molecular Framework
Not available
Substituents
Pheniramine - 2-phenylpropanoic-acid - P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Phenylpropane - Halobenzene - Aralkylamine - Chlorobenzene - Aryl chloride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - 1,2-aminoalcohol - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Secondary amine - Azacycle - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Aromatic alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pheniramines. These are compounds containing a pheniramine moiety, which is structurally characterized by the presence of a 2-benzylpyridine linked to an dimethyl(propyl)amine to form a dimethyl[3-phenyl-3-(pyridin-2-yl)propyl]amine skeleton.
External Descriptors
Not available