Compound Identification
SMILES
CCOC(=O)[C@@]12[C@H]([C@H]3COC(C)(C)O3)[C@@H]3CC[C@@]1(OCC)[C@@]2(CC1=CC=CC=C1Br)C3=O
InChIKey
InChIKey=AKPYLAFJOUEOCX-DVDRDERMSA-N
Formula
C25H31BrO6
Mass
507.421
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Bromobenzenes
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Subclass
Halobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Bromobenzenes
Alternative Parents
Ketals Cyclopropanecarboxylic acids and derivatives Aryl bromides 1,3-dioxolanes Ketones Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Organobromides Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Ketal - Bromobenzene - Aryl bromide - Aryl halide - Cyclopropanecarboxylic acid or derivatives - Meta-dioxolane - Carboxylic acid ester - Ketone - Acetal - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Aldehyde - Carbonyl group - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organobromide - Organic oxygen compound - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as bromobenzenes. These are organic compounds containing a bromine atom attached to a benzene ring.
External Descriptors
Not available