Compound Identification
SMILES
OC(=O)\C=C/C(O)=O.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=FUAYBCGDJFUMNL-CAIVAJMPSA-N
Formula
C43H56ClN3O7
Mass
762.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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 Unsaturated fatty acids Dicarboxylic acids and derivatives Aryl chlorides Heteroaromatic compounds Trialkylamines Secondary alcohols 1,2-aminoalcohols Dialkylamines Azacyclic compounds Carboxylic acids Organochlorides Hydrocarbon derivatives Organic oxides Carbonyl compounds Aromatic alcohols
Molecular Framework
Not available
Substituents
Pheniramine - 2-phenylpropanoic-acid - P-cymene - Aromatic monoterpenoid - Monoterpenoid - Monocyclic monoterpenoid - Phenylpropane - Chlorobenzene - Halobenzene - Aralkylamine - Aryl halide - Unsaturated fatty acid - Fatty acyl - Aryl chloride - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - Fatty acid - Heteroaromatic compound - 1,2-aminoalcohol - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Azacycle - Secondary amine - Carboxylic acid - Carboxylic acid derivative - Secondary aliphatic amine - 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