Compound Identification
SMILES
CC1=CC=CC=C1NC(=O)OCC1=CN=C(N1)C1=CC2=C(NC(=O)C(=N2)C(O)=O)C=C1[N+]([O-])=O
InChIKey
InChIKey=DJPUPGBGWUFILQ-UHFFFAOYSA-N
Formula
C21H16N6O7
Mass
464.394
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylcarbamic acid esters
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylcarbamic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Phenylcarbamic acid esters
Alternative Parents
Quinoxalines Pyrazine carboxylic acids Nitroaromatic compounds Imidazolyl carboxylic acids and derivatives Toluenes Vinylogous amides Carbamate esters Heteroaromatic compounds Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Carbonyl compounds Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylcarbamic acid ester - Quinoxaline - Pyrazine carboxylic acid - Pyrazine carboxylic acid or derivatives - Nitroaromatic compound - Imidazolyl carboxylic acid derivative - Toluene - Pyrazine - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Carbamic acid ester - Lactam - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Organic oxoazanium - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organic zwitterion - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylcarbamic acid esters. These are ester derivatives of phenylcarbamic acids.
External Descriptors
Not available