Compound Identification
SMILES
OC(=O)\C=C/C([O-])=O.OC(C[NH+]1CCCCCC1)C1=CC2=C(CCC2)C=C1
InChIKey
InChIKey=YDFDTSVNTWIXNB-BTJKTKAUSA-N
Formula
C21H29NO5
Mass
375.465
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Indanes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Indanes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Indanes
Alternative Parents
Aralkylamines Azepanes Unsaturated fatty acids Dicarboxylic acids and derivatives Quaternary ammonium salts 1,2-aminoalcohols Carboxylic acid salts Trialkylamines Secondary alcohols Carboxylic acids Azacyclic compounds Organic zwitterions Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework
Not available
Substituents
Indane - Azepane - Aralkylamine - Dicarboxylic acid or derivatives - Unsaturated fatty acid - Fatty acyl - Fatty acid - Quaternary ammonium salt - 1,2-aminoalcohol - Carboxylic acid salt - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Alcohol - Carbonyl group - Organic nitrogen compound - Aromatic alcohol - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indanes. These are compounds containing an indane moiety, which consists of a cyclopentane fused to a benzene ring.
External Descriptors
Not available