[5-[[2-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohex-2-en-1-yl]methyl]-2-methyl-phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [5-[[2-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohex-2-en-1-yl]methyl]-2-methyl-phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [5-[[2-(4,5-diphenyloxazol-2-yl)cyclohex-2-en-1-yl]methyl]-2-methyl-phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [5-[[2-(4,5-diphenyl-2-oxazolyl)-1-cyclohex-2-enyl]methyl]-2-methylphenyl] ester IUPAC Name: [5-[[2-(4,5-diphenyl-1,3-oxazol-2-yl)cyclohex-2-en-1-yl]methyl]-2-methylphenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [5-[[2-(4,5-diphenyloxazol-2-yl)cyclohex-2-en-1-yl]methyl]-2-methyl-phenyl] ester Formula: C30H26F3NO4S MolecularWeight: 553.59195

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2CCCC=C2C3=NC(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)CC2CCCC=C2C3=NC(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C30H26F3NO4S/c1-20-16-17-21(19-26(20)38-39(35,36)30(31,32)33)18-24-14-8-9-15-25(24)29-34-27(22-10-4-2-5-11-22)28(37-29)23-12-6-3-7-13-23/h2-7,10-13,15-17,19,24H,8-9,14,18H2,1H3