S-[(2R)-1-[(4-methoxyphenyl)-diphenyl-methoxy]-3-[(E)-3-phenylprop-2-enoxy]propan-2-yl] decanethioate

Systemtic Name: S-[(2R)-1-[(4-methoxyphenyl)-diphenyl-methoxy]-3-[(E)-3-phenylprop-2-enoxy]propan-2-yl] decanethioate Openeye Name: S-[(1R)-1-[[(E)-cinnamyl]oxymethyl]-2-[(4-methoxyphenyl)-diphenyl-methoxy]ethyl] decanethioate CAS Name: decanethioic acid S-[(2R)-1-[(4-methoxyphenyl)-diphenylmethoxy]-3-[(E)-3-phenylprop-2-enoxy]propan-2-yl] ester IUPAC Name: S-[(2R)-1-[(4-methoxyphenyl)-diphenylmethoxy]-3-[(E)-3-phenylprop-2-enoxy]propan-2-yl] decanethioate Traditional Name: decanethioic acid S-[(1R)-1-[[(E)-cinnamyl]oxymethyl]-2-[(4-methoxyphenyl)-diphenyl-methoxy]ethyl] ester Formula: C42H50O4S MolecularWeight: 650.909

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)SC(COCC=CC1=CC=CC=C1)COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCCCCCCCC(=O)S[C@H](COC/C=C/C1=CC=CC=C1)COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C42H50O4S/c1-3-4-5-6-7-8-18-27-41(43)47-40(33-45-32-19-22-35-20-12-9-13-21-35)34-46-42(36-23-14-10-15-24-36,37-25-16-11-17-26-37)38-28-30-39(44-2)31-29-38/h9-17,19-26,28-31,40H,3-8,18,27,32-34H2,1-2H3/b22-19+/t40-/m1/s1