[3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazol-4-yl] hexadecyl carbonate

Systemtic Name: [3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazol-4-yl] hexadecyl carbonate Openeye Name: [3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazol-4-yl] hexadecyl carbonate CAS Name: carbonic acid [3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl] hexadecyl ester IUPAC Name: [3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazol-4-yl] hexadecyl carbonate Traditional Name: carbonic acid cetyl [3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazol-4-yl] ester Formula: C27H39ClFNO4 MolecularWeight: 496.054263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)OC1=C(ON=C1C2=C(C=CC=C2Cl)F)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)OC1=C(ON=C1C2=C(C=CC=C2Cl)F)C

InChI

InChI=1S/C27H39ClFNO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-32-27(31)33-26-21(2)34-30-25(26)24-22(28)18-17-19-23(24)29/h17-19H,3-16,20H2,1-2H3