Indole-3-acetic acid, 1-((N-hydroxycarbamoyl)methyl)-5-methoxy-2-methyl-, tert-butyl ester
Basic information
- CAS
57846-32-9- Standard SMILES
COc1ccc2c(c1)c(CC(=O)OC(C)(C)C)c(C)n2CC(=O)NO- InChIKey
VGCCTCQNIABQBA-UHFFFAOYSA-N- Molecular formula
- C18H24N2O5
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.16852187
Names & identifiers
- Preferred name
- Indole-3-acetic acid, 1-((N-hydroxycarbamoyl)methyl)-5-methoxy-2-methyl-, tert-butyl ester
- IUPAC
- tert-butyl 2-[1-[2-(hydroxyamino)-2-oxoethyl]-5-methoxy-2-methylindol-3-yl]acetate
Names & synonyms
Indole-3-acetic acid, 1-((N-hydroxycarbamoyl)methyl)-5-methoxy-2-methyl-, tert-butyl ester57846-32-9BRN 04490511-((N-Hydroxycarbamoyl)methyl)-5-methoxy-2-methylindole-3-acetic acid tert-butyl esterAcido 2-metil-5-metossi-3-(carbo-tert-butossi-metil)-1-indolilacetoidrossammico [Italian]DTXSID30206558Acido 2-metil-5-metossi-3-(carbo-tert-butossi-metil)-1-indolilacetoidrossammicotert-Butyl {1-[2-(hydroxyamino)-2-oxoethyl]-5-methoxy-2-methyl-1H-indol-3-yl}acetate
Database identifiers
- CAS
57846-32-9- PubChem CID
- 42588
- DTXSID
DTXSID30206558
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 89.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 490
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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