S-tert-butyl 4,4,6,7,8-pentamethyl-3-oxidanyl-5-oxidanylidene-undec-10-enethioate

Systemtic Name: S-tert-butyl 4,4,6,7,8-pentamethyl-3-oxidanyl-5-oxidanylidene-undec-10-enethioate Openeye Name: S-tert-butyl 3-hydroxy-4,4,6,7,8-pentamethyl-5-oxo-undec-10-enethioate CAS Name: 3-hydroxy-4,4,6,7,8-pentamethyl-5-oxo-10-undecenethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 3-hydroxy-4,4,6,7,8-pentamethyl-5-oxoundec-10-enethioate Traditional Name: 3-hydroxy-5-keto-4,4,6,7,8-pentamethyl-undec-10-enethioic acid S-tert-butyl ester Formula: C20H36O3S MolecularWeight: 356.56304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC=C)C(C)C(C)C(=O)C(C)(C)C(CC(=O)SC(C)(C)C)O

Isomeric SMILES

CC(CC=C)C(C)C(C)C(=O)C(C)(C)C(CC(=O)SC(C)(C)C)O

InChI

InChI=1S/C20H36O3S/c1-10-11-13(2)14(3)15(4)18(23)20(8,9)16(21)12-17(22)24-19(5,6)7/h10,13-16,21H,1,11-12H2,2-9H3