Compound Identification
SMILES
COC1=CC=CC(=C1)C(\O)=C1\[C@H](N(CCC[NH+](C)C)C(=O)C1=O)C1=CC=C(C)O1
InChIKey
InChIKey=QESJJQVOHZNTAP-LFVOPCPISA-O
Formula
C22H27N2O5
Mass
399.466
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenol ethers
- Subclass Anisoles
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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 Tertiary carboxylic acid amides Vinylogous acids Heteroaromatic compounds Furans Quaternary ammonium salts Trialkylamines Lactams Cyclic ketones Amino acids and derivatives Oxacyclic compounds Enols Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Pyrrolidone - Monocyclic benzene moiety - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Pyrrolidine - Heteroaromatic compound - Quaternary ammonium salt - Tertiary carboxylic acid amide - Furan - Vinylogous acid - Carboxamide group - Tertiary aliphatic amine - Amino acid or derivatives - Cyclic ketone - Lactam - Tertiary amine - Ketone - Oxacycle - Carboxylic acid derivative - Enol - Ether - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - 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