Compound Identification
SMILES
OC(=O)[C@@H](CC1=CC=CC=C1)OC1=C(Br)C=C(C=C1Br)C1=C2C(SC3=CC=CC=C23)=C(Cl)C2=CC=CC=C12
InChIKey
InChIKey=ORLPTFBKEUIYPU-XMMPIXPASA-N
Formula
C31H19Br2ClO3S
Mass
666.81
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
- Subclass Naphthothiophenes
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
Naphthothiophenes
Alternative Parents
Dibenzothiophenes Phenylpropanoic acids Phenoxyacetic acid derivatives Chloronaphthalenes 1-benzothiophenes Phenoxy compounds Phenol ethers Alkyl aryl ethers Bromobenzenes Aryl bromides Aryl chlorides Thiophenes Heteroaromatic compounds Monocarboxylic acids and derivatives Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzothiophene - Naphthothiophene - Chloronaphthalene - 3-phenylpropanoic-acid - Phenoxyacetate - 1-benzothiophene - Benzothiophene - Phenoxy compound - Phenol ether - Alkyl aryl ether - Halobenzene - Bromobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Carbonyl group - Organohalogen compound - Organobromide - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthothiophenes. These are compounds containing a naphthalene (or a derivative) fused to thiophene.
External Descriptors
Not available