[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (E,2R)-2-oxidanyl-2-phenyl-oct-3-enoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (E,2R)-2-oxidanyl-2-phenyl-oct-3-enoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] (E,2R)-2-hydroxy-2-phenyl-oct-3-enoate CAS Name: (E,2R)-2-hydroxy-2-phenyl-3-octenoic acid [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (E,2R)-2-hydroxy-2-phenyloct-3-enoate Traditional Name: (E,2R)-2-hydroxy-2-phenyl-oct-3-enoic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C30H40O3 MolecularWeight: 448.6368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC(C1=CC=CC=C1)(C(=O)OC2CC(CCC2C(C)(C)C3=CC=CC=C3)C)O

Isomeric SMILES

CCCC/C=C/[C@@](C1=CC=CC=C1)(C(=O)O[C@@H]2C[C@@H](CC[C@H]2C(C)(C)C3=CC=CC=C3)C)O

InChI

InChI=1S/C30H40O3/c1-5-6-7-14-21-30(32,25-17-12-9-13-18-25)28(31)33-27-22-23(2)19-20-26(27)29(3,4)24-15-10-8-11-16-24/h8-18,21,23,26-27,32H,5-7,19-20,22H2,1-4H3/b21-14+/t23-,26-,27-,30-/m1/s1