phenyl 6-[2-(3,3-dimethyl-6-oxidanylidene-6-phenoxy-hexyl)sulfanylethylsulfanyl]-4,4-dimethyl-hexanoate

Systemtic Name: phenyl 6-[2-(3,3-dimethyl-6-oxidanylidene-6-phenoxy-hexyl)sulfanylethylsulfanyl]-4,4-dimethyl-hexanoate Openeye Name: phenyl 6-[2-(3,3-dimethyl-6-oxo-6-phenoxy-hexyl)sulfanylethylsulfanyl]-4,4-dimethyl-hexanoate CAS Name: 6-[2-[(3,3-dimethyl-6-oxo-6-phenoxyhexyl)thio]ethylthio]-4,4-dimethylhexanoic acid phenyl ester IUPAC Name: phenyl 6-[2-(3,3-dimethyl-6-oxo-6-phenoxyhexyl)sulfanylethylsulfanyl]-4,4-dimethylhexanoate Traditional Name: 6-[2-[(6-keto-3,3-dimethyl-6-phenoxy-hexyl)thio]ethylthio]-4,4-dimethyl-hexanoic acid phenyl ester Formula: C30H42O4S2 MolecularWeight: 530.78208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC(=O)OC1=CC=CC=C1)CCSCCSCCC(C)(C)CCC(=O)OC2=CC=CC=C2

Isomeric SMILES

CC(C)(CCC(=O)OC1=CC=CC=C1)CCSCCSCCC(C)(C)CCC(=O)OC2=CC=CC=C2

InChI

InChI=1S/C30H42O4S2/c1-29(2,17-15-27(31)33-25-11-7-5-8-12-25)19-21-35-23-24-36-22-20-30(3,4)18-16-28(32)34-26-13-9-6-10-14-26/h5-14H,15-24H2,1-4H3