Compound Identification
SMILES
C[C@@H](C1=CN(C(O)=O)C2=NC=C(Br)C=C12)C1=C(OC[C@@H]2COC(C)(C)O2)C=CC(F)=C1Cl
InChIKey
InChIKey=ZTFQAEUGVHWJMD-WCQYABFASA-N
Formula
C22H21BrClFN2O5
Mass
527.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrrolopyridines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyridines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolopyridines
Alternative Parents
Pyrrole carboxylic acids Phenoxy compounds Phenol ethers Alkyl aryl ethers Ketals Chlorobenzenes Fluorobenzenes Substituted pyrroles Pyridines and derivatives Aryl bromides Aryl chlorides Aryl fluorides 1,3-dioxolanes Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organochlorides Organofluorides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyridine - Phenoxy compound - Phenol ether - Pyrrole-1-carboxylic acid - Pyrrole-1-carboxylic acid or derivatives - Halobenzene - Alkyl aryl ether - Fluorobenzene - Ketal - Chlorobenzene - Aryl bromide - Aryl chloride - Aryl fluoride - Benzenoid - Substituted pyrrole - Monocyclic benzene moiety - Aryl halide - Pyridine - Heteroaromatic compound - Meta-dioxolane - Pyrrole - Acetal - Oxacycle - Azacycle - Ether - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organofluoride - Organohalogen compound - Organobromide - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolopyridines. These are compounds containing a pyrrolopyridine moiety, which consists of a pyrrole ring fused to a pyridine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
External Descriptors
Not available