(3S,6S)-1,8-diphenyl-3,6-bis(phenylmethoxymethyl)octane-4,5-diol

Systemtic Name: (3S,6S)-1,8-diphenyl-3,6-bis(phenylmethoxymethyl)octane-4,5-diol Openeye Name: (3S,6S)-3,6-bis(benzyloxymethyl)-1,8-diphenyl-octane-4,5-diol CAS Name: (3S,6S)-1,8-diphenyl-3,6-bis(phenylmethoxymethyl)octane-4,5-diol IUPAC Name: (3S,6S)-1,8-diphenyl-3,6-bis(phenylmethoxymethyl)octane-4,5-diol Traditional Name: (3S,6S)-3,6-bis(benzoxymethyl)-1,8-diphenyl-octane-4,5-diol Formula: C36H42O4 MolecularWeight: 538.71628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(COCC2=CC=CC=C2)C(C(C(CCC3=CC=CC=C3)COCC4=CC=CC=C4)O)O

Isomeric SMILES

C1=CC=C(C=C1)CC[C@@H](COCC2=CC=CC=C2)C(C([C@@H](CCC3=CC=CC=C3)COCC4=CC=CC=C4)O)O

InChI

InChI=1S/C36H42O4/c37-35(33(23-21-29-13-5-1-6-14-29)27-39-25-31-17-9-3-10-18-31)36(38)34(24-22-30-15-7-2-8-16-30)28-40-26-32-19-11-4-12-20-32/h1-20,33-38H,21-28H2/t33-,34-,35?,36?/m0/s1