Compound Identification
SMILES
COC(=O)C1=CC(N2C[C@@H]3OC(C)(C)O[C@@H]3[C@](OC)(O2)C=C)=C(I)C(OC)=C1
InChIKey
InChIKey=FWDSAMOTVYHPOW-URLQWDBASA-N
Formula
C19H24INO7
Mass
505.305
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
M-methoxybenzoic acids and derivatives
Alternative Parents
4-halobenzoic acids and derivatives Benzoic acid esters Methoxyanilines Phenoxy compounds 1-hydroxylamino, 2-unsubstituted benzenoids 1-hydroxylamino, 4-unsubstituted benzenoids Anisoles N-phenylhydroxylamines Benzoyl derivatives Methoxybenzenes Alkyl aryl ethers Iodobenzenes Ketals Aryl iodides 1,2-oxazinanes 1,3-dioxolanes Methyl esters Monocarboxylic acids and derivatives N-organohydroxylamines Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organoiodides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
M-methoxybenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoate ester - Methoxyaniline - Phenoxy compound - N-phenylhydroxylamine - 1-hydroxylamino, 4-unsubstituted benzenoid - Phenol ether - 1-hydroxylamino, 2-unsubstituted benzenoid - Benzoyl - Methoxybenzene - Anisole - Iodobenzene - Halobenzene - Ketal - Alkyl aryl ether - 1,2-oxazinane - Oxazinane - Aryl iodide - Aryl halide - Methyl ester - Meta-dioxolane - Carboxylic acid ester - Acetal - Oxacycle - Azacycle - N-organohydroxylamine - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Organopnictogen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organoiodide - Organic oxygen compound - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as m-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 3 of the benzene ring is replaced by a methoxy group.
External Descriptors
Not available