S-tert-butyl (3S)-3-(4-methoxyphenyl)-5-oxidanylidene-hexanethioate

Systemtic Name: S-tert-butyl (3S)-3-(4-methoxyphenyl)-5-oxidanylidene-hexanethioate Openeye Name: S-tert-butyl (3S)-3-(4-methoxyphenyl)-5-oxo-hexanethioate CAS Name: (3S)-3-(4-methoxyphenyl)-5-oxohexanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl (3S)-3-(4-methoxyphenyl)-5-oxohexanethioate Traditional Name: (3S)-5-keto-3-(4-methoxyphenyl)hexanethioic acid S-tert-butyl ester Formula: C17H24O3S MolecularWeight: 308.43566

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(CC(=O)SC(C)(C)C)C1=CC=C(C=C1)OC

Isomeric SMILES

CC(=O)C[C@@H](CC(=O)SC(C)(C)C)C1=CC=C(C=C1)OC

InChI

InChI=1S/C17H24O3S/c1-12(18)10-14(11-16(19)21-17(2,3)4)13-6-8-15(20-5)9-7-13/h6-9,14H,10-11H2,1-5H3/t14-/m0/s1