Compound Identification
SMILES
OCC(O)[C@@H]1OC(=O)[C@H](O)[C@H]1O.N\C(NC1=CC=C(Cl)C=C1)=N/C(N)=NCCCCCCN=C(N)\N=C(/N)NC1=CC=C(Cl)C=C1
InChIKey
InChIKey=DNWOZNSSPOOACF-SQQMVNFLSA-N
Formula
C28H40Cl2N10O6
Mass
683.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Chlorobenzenes
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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
Chlorobenzenes
Alternative Parents
Biguanides Aryl chlorides Gamma butyrolactones Oxolanes Secondary alcohols 1,2-diols Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Carboximidamides Monocarboxylic acids and derivatives Organochlorides Primary alcohols Organic oxides Hydrocarbon derivatives Imines Carbonyl compounds
Molecular Framework
Not available
Substituents
Biguanide - Chlorobenzene - Aryl chloride - Aryl halide - Gamma butyrolactone - Oxolane - 1,2-diol - Carboxylic acid ester - Guanidine - Lactone - Secondary alcohol - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Monocarboxylic acid or derivatives - Imine - Organic oxide - Organic oxygen compound - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Primary alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
External Descriptors
Not available