phenyl 5-[2-(3,3-dimethyl-5-oxidanylidene-5-phenoxy-pentyl)sulfanylethylsulfanyl]-3,3-dimethyl-pentanoate

Systemtic Name: phenyl 5-[2-(3,3-dimethyl-5-oxidanylidene-5-phenoxy-pentyl)sulfanylethylsulfanyl]-3,3-dimethyl-pentanoate Openeye Name: phenyl 5-[2-(3,3-dimethyl-5-oxo-5-phenoxy-pentyl)sulfanylethylsulfanyl]-3,3-dimethyl-pentanoate CAS Name: 5-[2-[(3,3-dimethyl-5-oxo-5-phenoxypentyl)thio]ethylthio]-3,3-dimethylpentanoic acid phenyl ester IUPAC Name: phenyl 5-[2-(3,3-dimethyl-5-oxo-5-phenoxypentyl)sulfanylethylsulfanyl]-3,3-dimethylpentanoate Traditional Name: 5-[2-[(5-keto-3,3-dimethyl-5-phenoxy-pentyl)thio]ethylthio]-3,3-dimethyl-valeric acid phenyl ester Formula: C28H38O4S2 MolecularWeight: 502.72892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38O4S2/c1-27(2,21-25(29)31-23-11-7-5-8-12-23)15-17-33-19-20-34-18-16-28(3,4)22-26(30)32-24-13-9-6-10-14-24/h5-14H,15-22H2,1-4H3