S-[(2R)-1-hexoxy-3-[(4-methoxyphenyl)-diphenyl-methoxy]propan-2-yl] 4-methylpentanethioate

Systemtic Name: S-[(2R)-1-hexoxy-3-[(4-methoxyphenyl)-diphenyl-methoxy]propan-2-yl] 4-methylpentanethioate Openeye Name: S-[(1R)-1-(hexoxymethyl)-2-[(4-methoxyphenyl)-diphenyl-methoxy]ethyl] 4-methylpentanethioate CAS Name: 4-methylpentanethioic acid S-[(2R)-1-hexoxy-3-[(4-methoxyphenyl)-diphenylmethoxy]propan-2-yl] ester IUPAC Name: S-[(2R)-1-hexoxy-3-[(4-methoxyphenyl)-diphenylmethoxy]propan-2-yl] 4-methylpentanethioate Traditional Name: 4-methylpentanethioic acid S-[(1R)-1-(hexoxymethyl)-2-[(4-methoxyphenyl)-diphenyl-methoxy]ethyl] ester Formula: C35H46O4S MolecularWeight: 562.80234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCC(COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=C(C=C3)OC)SC(=O)CCC(C)C

Isomeric SMILES

CCCCCCOC[C@H](COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=C(C=C3)OC)SC(=O)CCC(C)C

InChI

InChI=1S/C35H46O4S/c1-5-6-7-14-25-38-26-33(40-34(36)24-19-28(2)3)27-39-35(29-15-10-8-11-16-29,30-17-12-9-13-18-30)31-20-22-32(37-4)23-21-31/h8-13,15-18,20-23,28,33H,5-7,14,19,24-27H2,1-4H3/t33-/m1/s1