Compound Identification
SMILES
C[N+]1(CCCC1)[C@@]1(CCC2=C(C=C(N)C=C2)[C@H]1CC(=O)NC(=CC=O)C(O)=O)C1=CC(Cl)=C(Cl)C=C1
InChIKey
InChIKey=PCADGIVCROGRAZ-ZBLYBZFDSA-O
Formula
C27H30Cl2N3O4
Mass
531.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
- Subclass Phenylnaphthalenes
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Phenylnaphthalenes
Intermediate Tree Nodes
Not available
Direct Parent
Phenylnaphthalenes
Alternative Parents
N-acyl-alpha amino acids Tetralins Dichlorobenzenes Aralkylamines Aryl chlorides N-alkylpyrrolidines Vinylogous amides Tetraalkylammonium salts Enals Secondary carboxylic acid amides Amino acids Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Primary amines Aldehydes Organic oxides Organochlorides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylnaphthalene - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Alpha-amino acid or derivatives - Tetralin - 1,2-dichlorobenzene - Aralkylamine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - N-alkylpyrrolidine - Monocyclic benzene moiety - Alpha,beta-unsaturated aldehyde - Enal - Vinylogous amide - Tetraalkylammonium salt - Quaternary ammonium salt - Pyrrolidine - Amino acid - Carboxamide group - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxylic acid - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Aldehyde - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Primary amine - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylnaphthalenes. These are compounds containing a phenylnaphthalene skeleton, which consists of a naphthalene bound to a phenyl group.
External Descriptors
Not available