Compound Identification
SMILES
CCOC(=O)NC1=NC(N)=C(C(NCCCCC2=CC=CC=C2)=C1)[N+]([O-])=O
InChIKey
InChIKey=BXYOGZZFXYEGQW-UHFFFAOYSA-N
Formula
C18H23N5O4
Mass
373.413
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
Nitroaromatic compounds Secondary alkylarylamines Aminopyridines and derivatives Aralkylamines Imidolactams Carbamate esters Heteroaromatic compounds Organic carbonic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic zwitterions Organopnictogen compounds Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbutylamine - Nitroaromatic compound - Secondary aliphatic/aromatic amine - Aralkylamine - Aminopyridine - Imidolactam - Pyridine - Carbamic acid ester - Heteroaromatic compound - Organic nitro compound - Carbonic acid derivative - C-nitro compound - Azacycle - Secondary amine - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Amine - Organic zwitterion - Primary amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
Not available