ethyl 2-fluoranyl-4-(hexadecylamino)benzoate

Systemtic Name: ethyl 2-fluoranyl-4-(hexadecylamino)benzoate Openeye Name: ethyl 2-fluoro-4-(hexadecylamino)benzoate CAS Name: 2-fluoro-4-(hexadecylamino)benzoic acid ethyl ester IUPAC Name: ethyl 2-fluoro-4-(hexadecylamino)benzoate Traditional Name: 4-(cetylamino)-2-fluoro-benzoic acid ethyl ester Formula: C25H42FNO2 MolecularWeight: 407.604883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC(=C(C=C1)C(=O)OCC)F

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC(=C(C=C1)C(=O)OCC)F

InChI

InChI=1S/C25H42FNO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-20-27-22-18-19-23(24(26)21-22)25(28)29-4-2/h18-19,21,27H,3-17,20H2,1-2H3