tert-butyl 2-[4-[(4-methoxyphenyl)methylsulfanyl]pyrrolidin-2-yl]-2-oxidanyl-ethanoate

Systemtic Name: tert-butyl 2-[4-[(4-methoxyphenyl)methylsulfanyl]pyrrolidin-2-yl]-2-oxidanyl-ethanoate Openeye Name: tert-butyl 2-hydroxy-2-[4-[(4-methoxyphenyl)methylsulfanyl]pyrrolidin-2-yl]acetate CAS Name: 2-hydroxy-2-[4-[(4-methoxyphenyl)methylthio]-2-pyrrolidinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-hydroxy-2-[4-[(4-methoxyphenyl)methylsulfanyl]pyrrolidin-2-yl]acetate Traditional Name: 2-hydroxy-2-[4-(p-anisylthio)pyrrolidin-2-yl]acetic acid tert-butyl ester Formula: C18H27NO4S MolecularWeight: 353.47628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1CC(CN1)SCC2=CC=C(C=C2)OC)O

Isomeric SMILES

CC(C)(C)OC(=O)C(C1CC(CN1)SCC2=CC=C(C=C2)OC)O

InChI

InChI=1S/C18H27NO4S/c1-18(2,3)23-17(21)16(20)15-9-14(10-19-15)24-11-12-5-7-13(22-4)8-6-12/h5-8,14-16,19-20H,9-11H2,1-4H3