phenyl 4-[4-(3,3-dimethyl-4-oxidanylidene-4-phenoxy-butyl)sulfanylphenyl]sulfanyl-2,2-dimethyl-butanoate

Systemtic Name: phenyl 4-[4-(3,3-dimethyl-4-oxidanylidene-4-phenoxy-butyl)sulfanylphenyl]sulfanyl-2,2-dimethyl-butanoate Openeye Name: phenyl 4-[4-(3,3-dimethyl-4-oxo-4-phenoxy-butyl)sulfanylphenyl]sulfanyl-2,2-dimethyl-butanoate CAS Name: 4-[[4-[(3,3-dimethyl-4-oxo-4-phenoxybutyl)thio]phenyl]thio]-2,2-dimethylbutanoic acid phenyl ester IUPAC Name: phenyl 4-[4-(3,3-dimethyl-4-oxo-4-phenoxybutyl)sulfanylphenyl]sulfanyl-2,2-dimethylbutanoate Traditional Name: 4-[[4-[(4-keto-3,3-dimethyl-4-phenoxy-butyl)thio]phenyl]thio]-2,2-dimethyl-butyric acid phenyl ester Formula: C30H34O4S2 MolecularWeight: 522.71856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCSC1=CC=C(C=C1)SCCC(C)(C)C(=O)OC2=CC=CC=C2)C(=O)OC3=CC=CC=C3

Isomeric SMILES

CC(C)(CCSC1=CC=C(C=C1)SCCC(C)(C)C(=O)OC2=CC=CC=C2)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C30H34O4S2/c1-29(2,27(31)33-23-11-7-5-8-12-23)19-21-35-25-15-17-26(18-16-25)36-22-20-30(3,4)28(32)34-24-13-9-6-10-14-24/h5-18H,19-22H2,1-4H3