Compound Identification
SMILES
CCOC(=O)CN(C(=O)CSC1=C(C#N)C(=CC(=N1)C1=CC=C(OC)C=C1)C1=CC=CC=C1)C1=CC(=CC=C1)[N+]([O-])=O
InChIKey
InChIKey=BPKNCBSOGMBZDU-UHFFFAOYSA-N
Formula
C31H26N4O6S
Mass
582.63
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
-
Level 6
Alpha amino acids and derivatives
-
Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Alpha amino acid esters
Alternative Parents
Phenylpyridines Anilides Nitrobenzenes Phenoxy compounds 3-pyridinecarbonitriles Anisoles Nitroaromatic compounds Methoxybenzenes Alkyl aryl ethers Alkylarylthioethers Tertiary carboxylic acid amides Heteroaromatic compounds Carboxylic acid esters Organic oxoazanium compounds Nitriles Monocarboxylic acids and derivatives Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - 4-phenylpyridine - 2-phenylpyridine - Nitrobenzene - Anilide - Phenoxy compound - Phenol ether - Aryl thioether - 3-pyridinecarbonitrile - Nitroaromatic compound - Methoxybenzene - Anisole - Alkyl aryl ether - Alkylarylthioether - Benzenoid - Pyridine - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Carboxylic acid ester - Carboxamide group - Azacycle - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Thioether - Carbonyl group - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Cyanide - Organic zwitterion - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available