Compound Identification
SMILES
COC(=O)C1=CC=C(COC2=C(OC)C=C(C=C3SC(=O)N(CC4=CC=C(Br)C=C4)C3=O)C=C2)O1
InChIKey
InChIKey=KXZZUQWNOGWRGX-UHFFFAOYSA-N
Formula
C25H20BrNO7S
Mass
558.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Furans
-
Subclass
Furoic acid and derivatives
- Level 5 Furoic acid esters
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Subclass
Furoic acid and derivatives
-
Class
Furans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Furans
Subclass
Furoic acid and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Furoic acid esters
Alternative Parents
Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Bromobenzenes Thiazolidinediones Aryl bromides Methyl esters Heteroaromatic compounds Dicarboximides Thiocarbamic acid derivatives Azacyclic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Furoic acid ester - Phenol ether - Phenoxy compound - Anisole - Methoxybenzene - Halobenzene - Alkyl aryl ether - Thiazolidinedione - Bromobenzene - Aryl bromide - Benzenoid - Monocyclic benzene moiety - Aryl halide - Methyl ester - Thiazolidine - Dicarboximide - Heteroaromatic compound - Thiocarbamic acid derivative - Carboxylic acid ester - Oxacycle - Azacycle - Carboxylic acid derivative - Ether - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Organobromide - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as furoic acid esters. These are ester derivatives of furoic acid.
External Descriptors
Not available