Compound Identification
SMILES
CC1=CC=C(CC(=NC2=C(C=O)C=C(C=C2)[N+]([O-])=O)N2CCOCC2)C=C1
InChIKey
InChIKey=WCWJQDPKEHTPDG-UHFFFAOYSA-N
Formula
C20H21N3O4
Mass
367.405
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Nitrobenzenes
- Level 5 Nitrobenzaldehydes
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Subclass
Nitrobenzenes
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzaldehydes
Alternative Parents
Nitroaromatic compounds Benzoyl derivatives Benzaldehydes Toluenes Morpholines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Dialkyl ethers Carboxamidines Azacyclic compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzaldehyde - Benzaldehyde - Nitroaromatic compound - Benzoyl - Toluene - Aryl-aldehyde - Morpholine - Oxazinane - C-nitro compound - Organic nitro compound - Amidine - Organoheterocyclic compound - Carboxylic acid amidine - Dialkyl ether - Ether - Organic oxoazanium - Oxacycle - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Aldehyde - Organic salt - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzaldehydes. These are nitrobenzenes that carry an aldehyde group at any position of the benzene ring.
External Descriptors
Not available