Compound Identification
SMILES
CCCOC1=CC=C(NC(=O)CC2N(CCCN3N=C(C)C(=C3C)[N+]([O-])=O)C(=S)N(C2=O)C2=CC=C(C=C2)C(=O)OCC)C=C1
InChIKey
InChIKey=UPVHVXKEPJWDBU-UHFFFAOYSA-N
Formula
C31H36N6O7S
Mass
636.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Acylaminobenzoic acid and derivatives
Alternative Parents
Phenylimidazolidines Alpha amino acids and derivatives Benzoic acid esters N-phenylthioureas Anilides Benzoyl derivatives N-arylamides Nitroaromatic compounds Phenol ethers Phenoxy compounds Alkyl aryl ethers Imidazolidinones Heteroaromatic compounds Pyrazoles Secondary carboxylic acid amides Thioureas Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Phenylimidazolidine - Alpha-amino acid or derivatives - Benzoate ester - N-phenylthiourea - Anilide - Phenoxy compound - Nitroaromatic compound - Benzoyl - Phenol ether - N-arylamide - Alkyl aryl ether - Imidazolidinone - Azole - Imidazolidine - Heteroaromatic compound - Pyrazole - Thiourea - Secondary carboxylic acid amide - Organic nitro compound - Carboxamide group - C-nitro compound - Carboxylic acid ester - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Azacycle - Ether - Organic salt - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic zwitterion - Organosulfur compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors
Not available