6-(Carboxymethoxy)-5-({[4-(trifluoromethoxy)benzyl]amino}methyl)-2-naphthoic acid

HCID 10072393
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(O)COc1ccc2cc(C(=O)O)ccc2c1CNCc1ccc(OC(F)(F)F)cc1
InChIKey
CRTPRDCFVGVVFE-UHFFFAOYSA-N
Molecular formula
C22H18F3NO6
Average molar mass
449.4 g/mol

Names & identifiers

Preferred name
6-(Carboxymethoxy)-5-({[4-(trifluoromethoxy)benzyl]amino}methyl)-2-naphthoic acid
IUPAC
6-(carboxymethoxy)-5-[[[4-(trifluoromethoxy)phenyl]methylamino]methyl]naphthalene-2-carboxylic acid

Names & synonyms

6-(Carboxymethoxy)-5-({[4-(trifluoromethoxy)benzyl]amino}methyl)-2-naphthoic acidSCHEMBL6288701

Database identifiers

PubChem CID
10072393

Properties

Computed structural properties

XLogP
2
Topological polar surface area
105 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
10
Rotatable bonds
9
Heavy atoms
32

Related reactions

1 records
New reaction record

Linked notes

Loading…