O4-tert-butyl O3-methyl (2S,3S)-2-phenylsulfanyl-2,3-dihydro-1,4-oxazine-3,4-dicarboxylate

Systemtic Name: O4-tert-butyl O3-methyl (2S,3S)-2-phenylsulfanyl-2,3-dihydro-1,4-oxazine-3,4-dicarboxylate Openeye Name: O4-tert-butyl O3-methyl (2S,3S)-2-phenylsulfanyl-2,3-dihydro-1,4-oxazine-3,4-dicarboxylate CAS Name: (2S,3S)-2-(phenylthio)-2,3-dihydro-1,4-oxazine-3,4-dicarboxylic acid O4-tert-butyl ester O3-methyl ester IUPAC Name: 4-O-tert-butyl 3-O-methyl (2S,3S)-2-phenylsulfanyl-2,3-dihydro-1,4-oxazine-3,4-dicarboxylate Traditional Name: (2S,3S)-2-(phenylthio)-2,3-dihydro-1,4-oxazine-3,4-dicarboxylic acid O4-tert-butyl ester O3-methyl ester Formula: C17H21NO5S MolecularWeight: 351.41734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=COC(C1C(=O)OC)SC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CO[C@H]([C@@H]1C(=O)OC)SC2=CC=CC=C2

InChI

InChI=1S/C17H21NO5S/c1-17(2,3)23-16(20)18-10-11-22-15(13(18)14(19)21-4)24-12-8-6-5-7-9-12/h5-11,13,15H,1-4H3/t13-,15-/m0/s1