Compound Identification
SMILES
CCOC(=O)C(=CC1=CC=C(C=C1)[N+]([O-])=O)C1=NC2=C(C(C)=C(C)S2)C(=O)N1
InChIKey
InChIKey=SDXHBDGMJZCBKD-UHFFFAOYSA-N
Formula
C19H17N3O5S
Mass
399.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid esters
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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
Thienopyrimidines Nitrobenzenes Nitroaromatic compounds Fatty acid esters Pyrimidones Enoate esters Thiophenes Heteroaromatic compounds Lactams Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organic oxoazanium compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid ester - Nitrobenzene - Thienopyrimidine - Nitroaromatic compound - Fatty acid ester - Pyrimidone - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Fatty acyl - Thiophene - Heteroaromatic compound - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Organic nitro compound - Carboxylic acid ester - Lactam - C-nitro compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxoazanium - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Organic salt - Aromatic heteropolycyclic 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