ethanoyl 3-fluoranyl-4-(hexadecylamino)benzoate

Systemtic Name: ethanoyl 3-fluoranyl-4-(hexadecylamino)benzoate Openeye Name: acetyl 3-fluoro-4-(hexadecylamino)benzoate CAS Name: 3-fluoro-4-(hexadecylamino)benzoic acid acetyl ester IUPAC Name: acetyl 3-fluoro-4-(hexadecylamino)benzoate Traditional Name: 4-(cetylamino)-3-fluoro-benzoic acid acetyl ester Formula: C25H40FNO3 MolecularWeight: 421.588403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=C(C=C(C=C1)C(=O)OC(=O)C)F

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=C(C=C(C=C1)C(=O)OC(=O)C)F

InChI

InChI=1S/C25H40FNO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-27-24-18-17-22(20-23(24)26)25(29)30-21(2)28/h17-18,20,27H,3-16,19H2,1-2H3