Compound Identification
SMILES
COC(=O)C1=C2CC(C3OC(=O)N(C3C3=CC(OC3=O)C(C(C)=C)C(O2)=C1)C1=CC=C(Br)C=C1)C(C)=C
InChIKey
InChIKey=HFDUAROZIXOCLC-UHFFFAOYSA-N
Formula
C28H26BrNO7
Mass
568.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Furans
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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
Furan-3-carboxylic acid esters Bromobenzenes Oxazolidinones Aryl bromides Butenolides Methyl esters Heteroaromatic compounds Enoate esters Carbamate esters Lactones Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Furoic acid ester - Furan-3-carboxylic acid ester - Furan-3-carboxylic acid or derivatives - Halobenzene - Bromobenzene - Aryl bromide - Oxazolidinone - Benzenoid - 2-furanone - Aryl halide - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Oxazolidine - Dihydrofuran - Carbamic acid ester - Heteroaromatic compound - Methyl ester - Enoate ester - Carboxylic acid ester - Lactone - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Oxacycle - Organohalogen compound - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organobromide - Organonitrogen compound - Aromatic heteropolycyclic 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