Compound Identification
SMILES
CN(C)CC1=CC=CC=C1CNC(=O)C1=NN(C(C)=CC1=O)C1=CC=CC=C1[N+]([O-])=O
InChIKey
InChIKey=KROYYOFHBJXUKT-UHFFFAOYSA-N
Formula
C22H23N5O4
Mass
421.457
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
2-heteroaryl carboxamides Benzylamines Nitroaromatic compounds Phenylmethylamines Aralkylamines Pyridazines and derivatives Heteroaromatic compounds Vinylogous amides Cyclic ketones Amino acids and derivatives Secondary carboxylic acid amides Trialkylamines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - 2-heteroaryl carboxamide - Nitroaromatic compound - Benzylamine - Phenylmethylamine - Aralkylamine - Pyridazine - Vinylogous amide - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Carboxamide group - Amino acid or derivatives - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Cyclic ketone - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Organic salt - Organic oxide - Amine - Hydrocarbon derivative - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors
Not available