ethyl 6-(6-ethoxy-5-methyl-6-oxidanylidene-5-phenyl-hexyl)sulfanyl-2-methyl-2-phenyl-hexanoate

Systemtic Name: ethyl 6-(6-ethoxy-5-methyl-6-oxidanylidene-5-phenyl-hexyl)sulfanyl-2-methyl-2-phenyl-hexanoate Openeye Name: ethyl 6-(6-ethoxy-5-methyl-6-oxo-5-phenyl-hexyl)sulfanyl-2-methyl-2-phenyl-hexanoate CAS Name: 6-[(6-ethoxy-5-methyl-6-oxo-5-phenylhexyl)thio]-2-methyl-2-phenylhexanoic acid ethyl ester IUPAC Name: ethyl 6-(6-ethoxy-5-methyl-6-oxo-5-phenylhexyl)sulfanyl-2-methyl-2-phenylhexanoate Traditional Name: 6-[(6-ethoxy-6-keto-5-methyl-5-phenyl-hexyl)thio]-2-methyl-2-phenyl-hexanoic acid ethyl ester Formula: C30H42O4S MolecularWeight: 498.71708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CCCCSCCCCC(C)(C1=CC=CC=C1)C(=O)OCC)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C)(CCCCSCCCCC(C)(C1=CC=CC=C1)C(=O)OCC)C2=CC=CC=C2

InChI

InChI=1S/C30H42O4S/c1-5-33-27(31)29(3,25-17-9-7-10-18-25)21-13-15-23-35-24-16-14-22-30(4,28(32)34-6-2)26-19-11-8-12-20-26/h7-12,17-20H,5-6,13-16,21-24H2,1-4H3