S-tert-butyl (3R,5S)-5-[(4-methoxyphenyl)methoxy]-3-oxidanyl-oct-7-enethioate

Systemtic Name: S-tert-butyl (3R,5S)-5-[(4-methoxyphenyl)methoxy]-3-oxidanyl-oct-7-enethioate Openeye Name: S-tert-butyl (3R,5S)-3-hydroxy-5-[(4-methoxyphenyl)methoxy]oct-7-enethioate CAS Name: (3R,5S)-3-hydroxy-5-[(4-methoxyphenyl)methoxy]-7-octenethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl (3R,5S)-3-hydroxy-5-[(4-methoxyphenyl)methoxy]oct-7-enethioate Traditional Name: (3R,5S)-3-hydroxy-5-p-anisyloxy-oct-7-enethioic acid S-tert-butyl ester Formula: C20H30O4S MolecularWeight: 366.5148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC(=O)CC(CC(CC=C)OCC1=CC=C(C=C1)OC)O

Isomeric SMILES

CC(C)(C)SC(=O)C[C@@H](C[C@H](CC=C)OCC1=CC=C(C=C1)OC)O

InChI

InChI=1S/C20H30O4S/c1-6-7-18(12-16(21)13-19(22)25-20(2,3)4)24-14-15-8-10-17(23-5)11-9-15/h6,8-11,16,18,21H,1,7,12-14H2,2-5H3/t16-,18+/m1/s1