Compound Identification
SMILES
CC1(C)OC2=NC=NC(N)=C2C=C1C1=CC2=C(C=C1)C1(CC2)CCC(CC(O)=O)CC1
InChIKey
InChIKey=HCRBDOYOWQSRTF-UHFFFAOYSA-N
Formula
C25H29N3O3
Mass
419.525
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Indanes
- Subclass Indan-1-spirocyclohexanes
-
Class
Indanes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Indanes
Subclass
Indan-1-spirocyclohexanes
Intermediate Tree Nodes
Not available
Direct Parent
Indan-1-spirocyclohexanes
Alternative Parents
Pyranopyrimidines Pyranopyridines Alkyl aryl ethers Aminopyrimidines and derivatives Pyridines and derivatives Imidolactams Heteroaromatic compounds Amino acids Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indan-1-spirocyclohexane - Pyranopyridine - Pyranopyrimidine - Alkyl aryl ether - Aminopyrimidine - Pyridine - Pyrimidine - Imidolactam - Heteroaromatic compound - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxide - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indan-1-spirocyclohexanes. These are organic aromatic compounds containing a cyclohexane moiety linked to the 1-position of an indane moiety in a spiro configuration.
External Descriptors
Not available