Indole-1-acetic acid, 3-(p-fluorobenzoyl)-6-methoxy-2-methyl-
Basic information
- CAS
25803-21-8- Standard SMILES
COc1ccc2c(C(=O)c3ccc(F)cc3)c(C)n(CC(=O)O)c2c1- InChIKey
NSNZBVZOKLXXFU-UHFFFAOYSA-N- Molecular formula
- C19H16FNO4
- Average molar mass
- 341.3 g/mol
- Monoisotopic mass
- 341.10633615
Names & identifiers
- Preferred name
- Indole-1-acetic acid, 3-(p-fluorobenzoyl)-6-methoxy-2-methyl-
- IUPAC
- 2-[3-(4-fluorobenzoyl)-6-methoxy-2-methylindol-1-yl]acetic acid
- English name
- 3-(p-Fluorobenzoyl)-6-methoxy-2-methyl-1H-indole-1-acetic acid
- Molecular formula
- C19H16FNO4
- Molecular weight
- 341.33
Names & synonyms
25803-21-8INDOLE-1-ACETIC ACID, 3-(p-FLUOROBENZOYL)-6-METHOXY-2-METHYL-DTXSID50180462RefChem:1087346DTXCID60102953RU 4486BRN 1552199Fluoromethacin3-(p-Fluorobenzoyl)-6-methoxy-2-methyl-1-indoleacetic acidCarboxymethyl-1 methyl-2 p.fluorobenzoyl-3 indole [French]5-21-12-00657 (Beilstein Handbook Reference)Carboxymethyl-1 methyl-2 p.fluorobenzoyl-3 indole
Show more names
3-(p-Fluorobenzoyl)-6-methoxy-2-methyl-1H-indole-1-acetic acid1H-Indole-1-acetic acid, 3-(4-fluorobenzoyl)-6-methoxy-2-methyl-
SCHEMBL29463840FF96867NS00006821Q63398123[3-(4-fluorobenzoyl)-6-methoxy-2-methyl-1H-indol-1-yl]acetic acid3-(4-Fluorobenzoyl)-6-Methoxy-2-Methyl-1H-Indole-1-Acetic Acid
Database identifiers
- CAS
25803-21-8- PubChem CID
- 33177
- DTXSID
DTXSID50180462- Nikkaji
- J36.993D
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 506
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Compound notes
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