(phenylmethyl) 6-[3-(4,4-dimethyl-5-oxidanylidene-5-phenylmethoxy-pentyl)sulfanylpropylsulfanyl]-3,3-dimethyl-hexanoate

Systemtic Name: (phenylmethyl) 6-[3-(4,4-dimethyl-5-oxidanylidene-5-phenylmethoxy-pentyl)sulfanylpropylsulfanyl]-3,3-dimethyl-hexanoate Openeye Name: benzyl 6-[3-(5-benzyloxy-4,4-dimethyl-5-oxo-pentyl)sulfanylpropylsulfanyl]-3,3-dimethyl-hexanoate CAS Name: 6-[3-[(4,4-dimethyl-5-oxo-5-phenylmethoxypentyl)thio]propylthio]-3,3-dimethylhexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 6-[3-(4,4-dimethyl-5-oxo-5-phenylmethoxypentyl)sulfanylpropylsulfanyl]-3,3-dimethylhexanoate Traditional Name: 6-[3-[(5-benzoxy-5-keto-4,4-dimethyl-pentyl)thio]propylthio]-3,3-dimethyl-hexanoic acid benzyl ester Formula: C32H46O4S2 MolecularWeight: 558.83524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCSCCCSCCCC(C)(C)C(=O)OCC1=CC=CC=C1)CC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(CCCSCCCSCCCC(C)(C)C(=O)OCC1=CC=CC=C1)CC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C32H46O4S2/c1-31(2,24-29(33)35-25-27-14-7-5-8-15-27)18-11-20-37-22-13-23-38-21-12-19-32(3,4)30(34)36-26-28-16-9-6-10-17-28/h5-10,14-17H,11-13,18-26H2,1-4H3