Compound Identification
SMILES
CCOC(=O)\C=C/C1=C(SC(Br)=C1)[N+]([O-])=O
InChIKey
InChIKey=ARGKUAGXYFSKCF-ARJAWSKDSA-N
Formula
C9H8BrNO4S
Mass
306.13
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiophenes
-
Subclass
Nitrothiophenes
-
Level 5
Nitrohalothiophenes
- Level 6 2-nitrohalothiophenes
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Level 5
Nitrohalothiophenes
-
Subclass
Nitrothiophenes
-
Class
Thiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiophenes
Subclass
Nitrothiophenes
Intermediate Tree Nodes
Nitrohalothiophenes
Direct Parent
2-nitrohalothiophenes
Alternative Parents
2-nitrothiophenes Nitroaromatic compounds 2,3,5-trisubstituted thiophenes Fatty acid esters Heteroaromatic compounds Enoate esters Vinyl bromides Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Bromoalkenes Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organobromides Organic oxoanionic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-nitrohalothiophene - 2-nitrothiophene - Nitroaromatic compound - 2,3,5-trisubstituted thiophene - Fatty acid ester - Fatty acyl - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Organic nitro compound - C-nitro compound - Carboxylic acid ester - Bromoalkene - Haloalkene - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Vinyl halide - Vinyl bromide - Organic oxoazanium - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organic hyponitrite - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-nitrohalothiophenes. These are aromatic heterocyclic compound containing a thiophene ring that carries a nitro group attached at the 2-position, as well as an halogen atom.
External Descriptors
Not available