2-[2-(octylcarbamoylamino)-4-(trifluoromethyl)phenoxy]benzoic acid

Systemtic Name: 2-[2-(octylcarbamoylamino)-4-(trifluoromethyl)phenoxy]benzoic acid Openeye Name: 2-[2-(octylcarbamoylamino)-4-(trifluoromethyl)phenoxy]benzoic acid CAS Name: 2-[2-[[(octylamino)-oxomethyl]amino]-4-(trifluoromethyl)phenoxy]benzoic acid IUPAC Name: 2-[2-(octylcarbamoylamino)-4-(trifluoromethyl)phenoxy]benzoic acid Traditional Name: 2-[2-(octylcarbamoylamino)-4-(trifluoromethyl)phenoxy]benzoic acid Formula: C23H27F3N2O4 MolecularWeight: 452.46669

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)NC1=C(C=CC(=C1)C(F)(F)F)OC2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCCCCCCNC(=O)NC1=C(C=CC(=C1)C(F)(F)F)OC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C23H27F3N2O4/c1-2-3-4-5-6-9-14-27-22(31)28-18-15-16(23(24,25)26)12-13-20(18)32-19-11-8-7-10-17(19)21(29)30/h7-8,10-13,15H,2-6,9,14H2,1H3,(H,29,30)(H2,27,28,31)