(4S,5R,6R)-5-bromanyl-6-butyl-4-[[(S)-phenylsulfinyl]methyl]-1,3-oxazinan-2-one

Systemtic Name: (4S,5R,6R)-5-bromanyl-6-butyl-4-[[(S)-phenylsulfinyl]methyl]-1,3-oxazinan-2-one Openeye Name: (4S,5R,6R)-5-bromo-6-butyl-4-[[(S)-phenylsulfinyl]methyl]-1,3-oxazinan-2-one CAS Name: (4S,5R,6R)-5-bromo-6-butyl-4-[[(S)-phenylsulfinyl]methyl]-1,3-oxazinan-2-one IUPAC Name: (4S,5R,6R)-5-bromo-6-butyl-4-[[(S)-phenylsulfinyl]methyl]-1,3-oxazinan-2-one Traditional Name: (4S,5R,6R)-5-bromo-6-butyl-4-[[(S)-phenylsulfinyl]methyl]-1,3-oxazinan-2-one Formula: C15H20BrNO3S MolecularWeight: 374.2932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(C(NC(=O)O1)CS(=O)C2=CC=CC=C2)Br

Isomeric SMILES

CCCC[C@@H]1[C@@H]([C@@H](NC(=O)O1)C[S@](=O)C2=CC=CC=C2)Br

InChI

InChI=1S/C15H20BrNO3S/c1-2-3-9-13-14(16)12(17-15(18)20-13)10-21(19)11-7-5-4-6-8-11/h4-8,12-14H,2-3,9-10H2,1H3,(H,17,18)/t12-,13+,14+,21-/m0/s1