Compound Identification
SMILES
COC1=C(C=C(CN2CC[C@@](O)(CN3CCCCC3)C2)C=C1)C(O)=O
InChIKey
InChIKey=XGMRDHOFLWTNBC-LJQANCHMSA-N
Formula
C19H28N2O4
Mass
348.443
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
Methoxybenzoic acids and derivatives
Direct Parent
O-methoxybenzoic acids and derivatives
Alternative Parents
Benzoic acids Phenylmethylamines Phenoxy compounds Methoxybenzenes Benzylamines Benzoyl derivatives Anisoles Alkyl aryl ethers Aralkylamines Piperidines N-alkylpyrrolidines Tertiary alcohols Trialkylamines 1,2-aminoalcohols Amino acids Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-methoxybenzoic acid or derivatives - Benzoic acid - Anisole - Benzoyl - Benzylamine - Phenoxy compound - Phenol ether - Phenylmethylamine - Methoxybenzene - Aralkylamine - Alkyl aryl ether - N-alkylpyrrolidine - Piperidine - Tertiary alcohol - Pyrrolidine - Tertiary aliphatic amine - 1,2-aminoalcohol - Amino acid or derivatives - Tertiary amine - Amino acid - Azacycle - Ether - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxide - Alcohol - Organic nitrogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 2 of the benzene ring is replaced by a methoxy group.
External Descriptors
Not available