2-[[2-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methoxy]cyclooctyl]oxymethyl]-6-methyl-benzoic acid

Systemtic Name: 2-[[2-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methoxy]cyclooctyl]oxymethyl]-6-methyl-benzoic acid Openeye Name: 2-[[2-[[2-(4-fluorophenyl)oxazol-4-yl]methoxy]cyclooctoxy]methyl]-6-methyl-benzoic acid CAS Name: 2-[[2-[[2-(4-fluorophenyl)-4-oxazolyl]methoxy]cyclooctyl]oxymethyl]-6-methylbenzoic acid IUPAC Name: 2-[[2-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methoxy]cyclooctyl]oxymethyl]-6-methylbenzoic acid Traditional Name: 2-[[2-[[2-(4-fluorophenyl)oxazol-4-yl]methoxy]cyclooctoxy]methyl]-6-methyl-benzoic acid Formula: C27H30FNO5 MolecularWeight: 467.529203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COC2CCCCCCC2OCC3=COC(=N3)C4=CC=C(C=C4)F)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)COC2CCCCCCC2OCC3=COC(=N3)C4=CC=C(C=C4)F)C(=O)O

InChI

InChI=1S/C27H30FNO5/c1-18-7-6-8-20(25(18)27(30)31)15-32-23-9-4-2-3-5-10-24(23)33-16-22-17-34-26(29-22)19-11-13-21(28)14-12-19/h6-8,11-14,17,23-24H,2-5,9-10,15-16H2,1H3,(H,30,31)