ethyl 2,3,5,6-tetrakis(fluoranyl)-4-(hexadecylamino)benzoate

Systemtic Name: ethyl 2,3,5,6-tetrakis(fluoranyl)-4-(hexadecylamino)benzoate Openeye Name: ethyl 2,3,5,6-tetrafluoro-4-(hexadecylamino)benzoate CAS Name: 2,3,5,6-tetrafluoro-4-(hexadecylamino)benzoic acid ethyl ester IUPAC Name: ethyl 2,3,5,6-tetrafluoro-4-(hexadecylamino)benzoate Traditional Name: 4-(cetylamino)-2,3,5,6-tetrafluoro-benzoic acid ethyl ester Formula: C25H39F4NO2 MolecularWeight: 461.576273

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=C(C(=C(C(=C1F)F)C(=O)OCC)F)F

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=C(C(=C(C(=C1F)F)C(=O)OCC)F)F

InChI

InChI=1S/C25H39F4NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-30-24-22(28)20(26)19(21(27)23(24)29)25(31)32-4-2/h30H,3-18H2,1-2H3