Compound Identification
SMILES
Cl.OC(=O)CCC1=CC=C(C=C1)N1CCN(CCN2CCNCC2=O)C1=O
InChIKey
InChIKey=FWSWUNRLFWKJEK-UHFFFAOYSA-N
Formula
C18H25ClN4O4
Mass
396.87
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Phenylpropanoic acids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Phenylpropanoic acids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropanoic acids
Alternative Parents
Phenylimidazolidines Alpha amino acids and derivatives N-alkylpiperazines Imidazolidinones Benzene and substituted derivatives Tertiary carboxylic acid amides Ureas Amino acids Lactams Monocarboxylic acids and derivatives Azacyclic compounds Dialkylamines Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Hydrochlorides Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylimidazolidine - 3-phenylpropanoic-acid - Alpha-amino acid or derivatives - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Imidazolidinone - Benzenoid - Piperazine - Imidazolidine - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Amino acid - Lactam - Urea - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Secondary amine - Hydrocarbon derivative - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrochloride - Organopnictogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.
External Descriptors
Not available