tert-butyl (Z)-6-tert-butylsulfanyl-2-cyano-5-methyl-3-oxidanyl-hex-4-enoate

Systemtic Name: tert-butyl (Z)-6-tert-butylsulfanyl-2-cyano-5-methyl-3-oxidanyl-hex-4-enoate Openeye Name: tert-butyl (Z)-6-tert-butylsulfanyl-2-cyano-3-hydroxy-5-methyl-hex-4-enoate CAS Name: (Z)-6-(tert-butylthio)-2-cyano-3-hydroxy-5-methyl-4-hexenoic acid tert-butyl ester IUPAC Name: tert-butyl (Z)-6-tert-butylsulfanyl-2-cyano-3-hydroxy-5-methylhex-4-enoate Traditional Name: (Z)-6-(tert-butylthio)-2-cyano-3-hydroxy-5-methyl-hex-4-enoic acid tert-butyl ester Formula: C16H27NO3S MolecularWeight: 313.45548

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(C(C#N)C(=O)OC(C)(C)C)O)CSC(C)(C)C

Isomeric SMILES

C/C(=C/C(C(C#N)C(=O)OC(C)(C)C)O)/CSC(C)(C)C

InChI

InChI=1S/C16H27NO3S/c1-11(10-21-16(5,6)7)8-13(18)12(9-17)14(19)20-15(2,3)4/h8,12-13,18H,10H2,1-7H3/b11-8-