2-ethoxyethyl 2-fluoranyl-4-(hexadecylamino)benzoate

Systemtic Name: 2-ethoxyethyl 2-fluoranyl-4-(hexadecylamino)benzoate Openeye Name: 2-ethoxyethyl 2-fluoro-4-(hexadecylamino)benzoate CAS Name: 2-fluoro-4-(hexadecylamino)benzoic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl 2-fluoro-4-(hexadecylamino)benzoate Traditional Name: 4-(cetylamino)-2-fluoro-benzoic acid 2-ethoxyethyl ester Formula: C27H46FNO3 MolecularWeight: 451.657443

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H46FNO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-20-29-24-18-19-25(26(28)23-24)27(30)32-22-21-31-4-2/h18-19,23,29H,3-17,20-22H2,1-2H3