Basic information
- Standard SMILES
COC(=O)c1ccc2c(CNCc3ccc(OC(F)(F)F)cc3)c(OC)ccc2c1- InChIKey
CSVYPWYWIOPNPC-UHFFFAOYSA-N- Molecular formula
- C22H20F3NO4
- Average molar mass
- 419.4 g/mol
Names & identifiers
- Preferred name
- 6-Methoxy-5-({[4-(trifluoromethoxy)benzyl]amino}methyl)-2-naphthoic acid methyl ester
- IUPAC
- methyl 6-methoxy-5-[[[4-(trifluoromethoxy)phenyl]methylamino]methyl]naphthalene-2-carboxylate
Names & synonyms
6-Methoxy-5-({[4-(trifluoromethoxy)benzyl]amino}methyl)-2-naphthoic acid methyl esterSCHEMBL62879496-methoxy-5-({[4-(trifluoromethoxy)-benzyl]amino}methyl)-2-naphthoic acid methyl ester
Database identifiers
- PubChem CID
- 69733138
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 551
Related reactions
4 records
Compound notes
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