Compound Identification
SMILES
[O-][N+](=O)C1=CN=C(NC2=CC=C(Cl)C=C2)N=C1NCCCN(CC1=CC=CC=C1)CC1=CC=CC=C1
InChIKey
InChIKey=XQOGFPCWFNNKPM-UHFFFAOYSA-N
Formula
C27H27ClN6O2
Mass
503.0
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylmethylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylmethylamines
Alternative Parents
Aniline and substituted anilines Benzylamines Nitroaromatic compounds Aminopyrimidines and derivatives Aralkylamines Chlorobenzenes Aryl chlorides Imidolactams Heteroaromatic compounds Trialkylamines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic salts Organopnictogen compounds Organic zwitterions Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitroaromatic compound - Benzylamine - Phenylmethylamine - Aniline or substituted anilines - Aminopyrimidine - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Pyrimidine - Imidolactam - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Tertiary amine - Tertiary aliphatic amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Organic oxoazanium - Organic salt - Organochloride - Organonitrogen compound - Organohalogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
External Descriptors
Not available