[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 3-(4,5-diphenyl-1,3-oxazol-2-yl)propanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 3-(4,5-diphenyl-1,3-oxazol-2-yl)propanoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 3-(4,5-diphenyloxazol-2-yl)propanoate CAS Name: 3-(4,5-diphenyl-2-oxazolyl)propanoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 3-(4,5-diphenyl-1,3-oxazol-2-yl)propanoate Traditional Name: 3-(4,5-diphenyloxazol-2-yl)propionic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C28H33NO3 MolecularWeight: 431.56652

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)CCC2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)CCC2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)C(C)C

InChI

InChI=1S/C28H33NO3/c1-19(2)23-15-14-20(3)18-24(23)31-26(30)17-16-25-29-27(21-10-6-4-7-11-21)28(32-25)22-12-8-5-9-13-22/h4-13,19-20,23-24H,14-18H2,1-3H3/t20-,23+,24-/m1/s1