[(2R)-1-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-methoxyphenyl)propan-2-yl]azanium; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: [(2R)-1-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-methoxyphenyl)propan-2-yl]azanium; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: [(1R)-1-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]-2-(4-methoxyphenyl)ethyl]ammonium; 2,2,2-trifluoroacetate CAS Name: [(2R)-1-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-(4-methoxyphenyl)propan-2-yl]ammonium; 2,2,2-trifluoroacetate IUPAC Name: [(2R)-1-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-methoxyphenyl)propan-2-yl]azanium; 2,2,2-trifluoroacetate Traditional Name: [(1R)-1-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]-2-(4-methoxyphenyl)ethyl]ammonium; 2,2,2-trifluoroacetate Formula: C27H27F3N2O5 MolecularWeight: 516.50889

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(CNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)[NH3+].C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C[C@H](CNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)[NH3+].C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C25H26N2O3.C2HF3O2/c1-29-19-12-10-17(11-13-19)14-18(26)15-27-25(28)30-16-24-22-8-4-2-6-20(22)21-7-3-5-9-23(21)24;3-2(4,5)1(6)7/h2-13,18,24H,14-16,26H2,1H3,(H,27,28);(H,6,7)/t18-;/m1./s1