Compound Identification
SMILES
COC1=CC=CC(=C1)C(\O)=C1\[C@@H](N(CC[NH+](C)C)C(=O)C1=O)C1=CC=CS1
InChIKey
InChIKey=FAXODOKXPZFNHB-HVESIFNPSA-O
Formula
C20H23N2O4S
Mass
387.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenol ethers
- Subclass Anisoles
-
Class
Phenol ethers
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Anisoles
Intermediate Tree Nodes
Not available
Direct Parent
Anisoles
Alternative Parents
Methoxybenzenes Phenoxy compounds Alkyl aryl ethers N-alkylpyrrolidines Pyrrolidine-2-ones Pyrrolidine-3-ones Vinylogous acids Heteroaromatic compounds Thiophenes Tertiary carboxylic acid amides Quaternary ammonium salts Trialkylamines Lactams Amino acids and derivatives Cyclic ketones Azacyclic compounds Enols Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Pyrrolidine - Heteroaromatic compound - Quaternary ammonium salt - Tertiary carboxylic acid amide - Thiophene - Vinylogous acid - Cyclic ketone - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Lactam - Ketone - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Enol - Ether - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
External Descriptors
Not available