tert-butyl (3R)-3-(2-sulfanylidenepyrrolidin-1-yl)octanoate

Systemtic Name: tert-butyl (3R)-3-(2-sulfanylidenepyrrolidin-1-yl)octanoate Openeye Name: tert-butyl (3R)-3-(2-thioxopyrrolidin-1-yl)octanoate CAS Name: (3R)-3-(2-sulfanylidene-1-pyrrolidinyl)octanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-(2-sulfanylidenepyrrolidin-1-yl)octanoate Traditional Name: (3R)-3-(2-thioxopyrrolidino)caprylic acid tert-butyl ester Formula: C16H29NO2S MolecularWeight: 299.47196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)OC(C)(C)C)N1CCCC1=S

Isomeric SMILES

CCCCC[C@H](CC(=O)OC(C)(C)C)N1CCCC1=S

InChI

InChI=1S/C16H29NO2S/c1-5-6-7-9-13(17-11-8-10-14(17)20)12-15(18)19-16(2,3)4/h13H,5-12H2,1-4H3/t13-/m1/s1