[5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-oxidanyl-2-[4-(3-oxidanylpropyl)phenyl]-2-phenyl-ethanoate

Systemtic Name: [5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-oxidanyl-2-[4-(3-oxidanylpropyl)phenyl]-2-phenyl-ethanoate Openeye Name: [5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] 2-hydroxy-2-[4-(3-hydroxypropyl)phenyl]-2-phenyl-acetate CAS Name: 2-hydroxy-2-[4-(3-hydroxypropyl)phenyl]-2-phenylacetic acid [5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester IUPAC Name: [5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-hydroxy-2-[4-(3-hydroxypropyl)phenyl]-2-phenylacetate Traditional Name: 2-hydroxy-2-[4-(3-hydroxypropyl)phenyl]-2-phenyl-acetic acid (2-cumyl-5-methyl-cyclohexyl) ester Formula: C33H40O4 MolecularWeight: 500.6683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=C(C=C3)CCCO)O)C(C)(C)C4=CC=CC=C4

Isomeric SMILES

CC1CCC(C(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=C(C=C3)CCCO)O)C(C)(C)C4=CC=CC=C4

InChI

InChI=1S/C33H40O4/c1-24-16-21-29(32(2,3)26-12-6-4-7-13-26)30(23-24)37-31(35)33(36,27-14-8-5-9-15-27)28-19-17-25(18-20-28)11-10-22-34/h4-9,12-15,17-20,24,29-30,34,36H,10-11,16,21-23H2,1-3H3