2-oxidanylidene-2-[[4-[2-(4-phenylmethoxyphenyl)ethynyl]phenyl]methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]ethanoic acid

Systemtic Name: 2-oxidanylidene-2-[[4-[2-(4-phenylmethoxyphenyl)ethynyl]phenyl]methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]ethanoic acid Openeye Name: 2-[[4-[2-(4-benzyloxyphenyl)ethynyl]phenyl]methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-2-oxo-acetic acid CAS Name: 2-oxo-2-[[4-[2-(4-phenylmethoxyphenyl)ethynyl]phenyl]methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]acetic acid IUPAC Name: 2-oxo-2-[[4-[2-(4-phenylmethoxyphenyl)ethynyl]phenyl]methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]acetic acid Traditional Name: 2-[[4-[2-(4-benzoxyphenyl)ethynyl]benzyl]-[4-(trifluoromethyl)benzyl]amino]-2-keto-acetic acid Formula: C32H24F3NO4 MolecularWeight: 543.53247

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C#CC3=CC=C(C=C3)CN(CC4=CC=C(C=C4)C(F)(F)F)C(=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C#CC3=CC=C(C=C3)CN(CC4=CC=C(C=C4)C(F)(F)F)C(=O)C(=O)O

InChI

InChI=1S/C32H24F3NO4/c33-32(34,35)28-16-12-26(13-17-28)21-36(30(37)31(38)39)20-25-10-8-23(9-11-25)6-7-24-14-18-29(19-15-24)40-22-27-4-2-1-3-5-27/h1-5,8-19H,20-22H2,(H,38,39)