Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C(N1CCCC(C1)C(O)=O)C1=CC2=CC=CC=C2S1
InChIKey
InChIKey=JTSXVBFLZXMWCV-UHFFFAOYSA-N
Formula
C23H25NO4S
Mass
411.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Methoxybenzenes
- Level 5 Dimethoxybenzenes
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Subclass
Methoxybenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Methoxybenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Dimethoxybenzenes
Alternative Parents
Piperidinecarboxylic acids 1-benzothiophenes Phenoxy compounds 2,3,5-trisubstituted thiophenes Anisoles Alkyl aryl ethers Aralkylamines Heteroaromatic compounds Trialkylamines Amino acids Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dimethoxybenzene - O-dimethoxybenzene - Piperidinecarboxylic acid - Benzothiophene - 1-benzothiophene - 2,3,5-trisubstituted thiophene - Phenoxy compound - Phenol ether - Anisole - Aralkylamine - Alkyl aryl ether - Piperidine - Thiophene - Heteroaromatic compound - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Amino acid - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Amine - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.
External Descriptors
Not available