Compound Identification
SMILES
OC(=O)CCC(O)=O.CCC(C)N1N=CN(C1=O)C1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(OCC2COC(CN3C=NC=N3)(O2)C2=C(Cl)C=C(Cl)C=C2)C=C1
InChIKey
InChIKey=BGOXQXQEHRCAKV-UHFFFAOYSA-N
Formula
C39H44Cl2N8O8
Mass
823.73
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
-
Subclass
Piperazines
- Level 5 Phenylpiperazines
-
Subclass
Piperazines
-
Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpiperazines
Alternative Parents
N-arylpiperazines Phenyl-1,2,4-triazoles Aminophenyl ethers Phenoxy compounds Aniline and substituted anilines Dichlorobenzenes Dialkylarylamines Alkyl aryl ethers Ketals Aryl chlorides Fatty acids and conjugates Dicarboxylic acids and derivatives 1,3-dioxolanes Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides Organopnictogen compounds Carbonyl compounds Organochlorides
Molecular Framework
Not available
Substituents
Phenylpiperazine - N-arylpiperazine - Phenyltriazole - Phenyl-1,2,4-triazole - Aminophenyl ether - 1,3-dichlorobenzene - Phenol ether - Tertiary aliphatic/aromatic amine - Phenoxy compound - Dialkylarylamine - Aniline or substituted anilines - Ketal - Chlorobenzene - Halobenzene - Alkyl aryl ether - Aryl chloride - Fatty acid - Benzenoid - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Heteroaromatic compound - Azole - 1,2,4-triazole - Meta-dioxolane - Triazole - Tertiary amine - Acetal - Oxacycle - Ether - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organochloride - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organohalogen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl group.
External Descriptors
Not available