O1-tert-butyl O2-ethyl 4-cyclohexylsulfanylpyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-ethyl 4-cyclohexylsulfanylpyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-ethyl 4-cyclohexylsulfanylpyrrolidine-1,2-dicarboxylate CAS Name: 4-(cyclohexylthio)pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester IUPAC Name: 1-O-tert-butyl 2-O-ethyl 4-cyclohexylsulfanylpyrrolidine-1,2-dicarboxylate Traditional Name: 4-(cyclohexylthio)pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester Formula: C18H31NO4S MolecularWeight: 357.50804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(CN1C(=O)OC(C)(C)C)SC2CCCCC2

Isomeric SMILES

CCOC(=O)C1CC(CN1C(=O)OC(C)(C)C)SC2CCCCC2

InChI

InChI=1S/C18H31NO4S/c1-5-22-16(20)15-11-14(24-13-9-7-6-8-10-13)12-19(15)17(21)23-18(2,3)4/h13-15H,5-12H2,1-4H3