Compound Identification
SMILES
CC1=CC=CC(C(=O)N2CC[NH+](CC(=O)N3CCCC3)CC2)=C1[N+]([O-])=O
InChIKey
InChIKey=NQIKDSKLNNSLCR-UHFFFAOYSA-O
Formula
C18H25N4O4
Mass
361.421
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
-
Level 5
Toluamides
-
Level 6
m-Toluamides
- Level 7 N,N-dialkyl-m-toluamides
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Level 6
m-Toluamides
-
Level 5
Toluamides
-
Subclass
Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Toluamides - m-Toluamides
Direct Parent
N,N-dialkyl-m-toluamides
Alternative Parents
Alpha amino acids and derivatives N-piperazineacetamides Benzamides Nitrotoluenes Nitrobenzenes Nitroaromatic compounds N-acylpyrrolidines Benzoyl derivatives N-alkylpiperazines Tertiary carboxylic acid amides Quaternary ammonium salts Trialkylamines Organic oxoazanium compounds Azacyclic compounds Organic salts Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-dialkyl-m-toluamide - Alpha-amino acid or derivatives - N-piperazineacetamide - Nitrobenzene - Benzamide - Benzoic acid or derivatives - Nitrotoluene - Nitroaromatic compound - Benzoyl - N-acylpyrrolidine - N-alkylpiperazine - Piperazine - 1,4-diazinane - Tertiary carboxylic acid amide - Quaternary ammonium salt - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Organic nitro compound - Carboxamide group - C-nitro compound - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxoazanium - Organic salt - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n,n-dialkyl-m-toluamides. These are aromatic that contain a m-toluamide, where the carboxamide group is N- substituted with two alkyl chains.
External Descriptors
Not available