Compound Identification
SMILES
COC1N=C(C)C(C(=O)OCCC#N)=C(N1C(=O)OC)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=SEOGGGQTMQOLGQ-UHFFFAOYSA-N
Formula
C18H18N4O7
Mass
402.363
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid esters
-
Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acid esters
Alternative Parents
Hydropyrimidine carboxylic acids and derivatives Pyrimidinecarboxylic acids Nitrobenzenes Nitroaromatic compounds Methylcarbamates Vinylogous amides Enoate esters Ketimines Orthocarboxylic acid derivatives Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Nitriles Monocarboxylic acids and derivatives Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid ester - Hydropyrimidine carboxylic acid derivative - Hydropyrimidine-1-carboxylate - Nitrobenzene - Pyrimidine-1-carboxylic acid - Nitroaromatic compound - Monocyclic benzene moiety - Hydropyrimidine - 1,2-dihydropyrimidine - Benzenoid - Methylcarbamate - Carbamic acid ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Carboxylic acid ester - Ketimine - C-nitro compound - Orthocarboxylic acid derivative - Organic nitro compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic oxoazanium - Azacycle - Organic nitrogen compound - Organic salt - Organic oxygen compound - Cyanide - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Imine - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid.
External Descriptors
Not available