Compound Identification
SMILES
CC1=CC(OCCCC2=NOC(=C2)C2=C([C@H]3CNC[C@@H](C2)N3)C(=O)N(CC2=C(Cl)C(Cl)=CC=C2)C2CC2)=CC(C)=C1Cl
InChIKey
InChIKey=DDVNMNJOHVFTHU-AJTFRIOCSA-N
Formula
C32H35Cl3N4O3
Mass
630.01
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
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Level 5
Chlorobenzenes
- Level 6 Dichlorobenzenes
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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
Chlorobenzenes
Direct Parent
Dichlorobenzenes
Alternative Parents
m-Xylenes Phenoxy compounds Phenol ethers Alkyl aryl ethers Piperazines Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Isoxazoles Amino acids and derivatives Dialkylamines Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxy compound - M-xylene - Xylene - 1,2-dichlorobenzene - Phenol ether - Alkyl aryl ether - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - Heteroaromatic compound - Azole - Tertiary carboxylic acid amide - Isoxazole - Amino acid or derivatives - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Secondary aliphatic amine - Organoheterocyclic compound - Secondary amine - Ether - Organic oxygen compound - Amine - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
External Descriptors
Not available