Basic information
- CAS
54871-12-4- Standard SMILES
COc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccccc1O- InChIKey
GRMRQLKCYWGDJZ-UHFFFAOYSA-N- Molecular formula
- C19H17NO5
- Average molar mass
- 339.3 g/mol
- Monoisotopic mass
- 339.11067264
Overview
structure
Names & identifiers
- Preferred name
- N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid
- IUPAC
- 2-[1-(2-hydroxybenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid
Names & synonyms
N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid54871-12-4DTXSID002033571H-INDOLE-3-ACETIC ACID, 1-(2-HYDROXYBENZOYL)-5-METHOXY-2-METHYL-RefChem:164179DTXCID00125848BRN 0449611(1-Salicyloyl)-2-methyl-5-methoxyindolyl-3-acetic acid1-(2-Hydroxybenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid2-[1-(2-hydroxybenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acidKwas(1-salicyloilo)-2-metylo-5-metoksy-3-indolilooctowy [Polish]5-22-05-00245 (Beilstein Handbook Reference)
Show more names
Kwas(1-salicyloilo)-2-metylo-5-metoksy-3-indolilooctowy[1-(2-hydroxybenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetic acid
Database identifiers
- CAS
54871-12-4- PubChem CID
- 41215
- DTXSID
DTXSID00203357
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 88.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 510
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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