tert-butyl N-[(3R,9R)-9-methyl-2-oxidanylidene-1-oxa-5-thiacyclonon-6-yn-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3R,9R)-9-methyl-2-oxidanylidene-1-oxa-5-thiacyclonon-6-yn-3-yl]carbamate Openeye Name: tert-butyl N-[(3R,9R)-9-methyl-2-oxo-1-oxa-5-thiacyclonon-6-yn-3-yl]carbamate CAS Name: N-[(3R,9R)-9-methyl-2-oxo-1-oxa-5-thiacyclonon-6-yn-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3R,9R)-9-methyl-2-oxo-1-oxa-5-thiacyclonon-6-yn-3-yl]carbamate Traditional Name: N-[(3R,9R)-2-keto-9-methyl-1-oxa-5-thiacyclonon-6-yn-3-yl]carbamic acid tert-butyl ester Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC#CSCC(C(=O)O1)NC(=O)OC(C)(C)C

Isomeric SMILES

C[C@@H]1CC#CSC[C@@H](C(=O)O1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C13H19NO4S/c1-9-6-5-7-19-8-10(11(15)17-9)14-12(16)18-13(2,3)4/h9-10H,6,8H2,1-4H3,(H,14,16)/t9-,10+/m1/s1