Compound Identification
SMILES
CCOC(=O)C1=[N+]([O-])OC(C1C1=CC(=CC=C1)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=RAECLPCBKMZWNB-UHFFFAOYSA-N
Formula
C12H11N3O8
Mass
325.233
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Alpha-imino acid and derivatives
- Level 5 Alpha-imino acid esters
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Subclass
Alpha-imino acid and derivatives
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Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Alpha-imino acid and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Alpha-imino acid esters
Alternative Parents
Nitrobenzenes Nitroaromatic compounds Isoxazolines Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-imino acid ester - Nitrobenzene - Nitroaromatic compound - Monocyclic benzene moiety - Benzenoid - Isoxazoline - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Organoheterocyclic compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Oxacycle - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic salt - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Organic zwitterion - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha-imino acid esters. These are ester derivatives of alpha-imino acids. They have the general structure RN=CC(=O)OR', where R = H, organyl group and R' = organyl group.
External Descriptors
Not available