(3R,6S)-6-tert-butyl-3-(dioxidanyl)-5-methoxy-6-methyl-3-(phenylmethyl)-1,4-oxazin-2-one

Systemtic Name: (3R,6S)-6-tert-butyl-3-(dioxidanyl)-5-methoxy-6-methyl-3-(phenylmethyl)-1,4-oxazin-2-one Openeye Name: (3R,6S)-3-benzyl-6-tert-butyl-3-hydroperoxy-5-methoxy-6-methyl-1,4-oxazin-2-one CAS Name: (3R,6S)-6-tert-butyl-3-hydroperoxy-5-methoxy-6-methyl-3-(phenylmethyl)-1,4-oxazin-2-one IUPAC Name: (3R,6S)-3-benzyl-6-tert-butyl-3-hydroperoxy-5-methoxy-6-methyl-1,4-oxazin-2-one Traditional Name: (3R,6S)-3-benzyl-6-tert-butyl-3-hydroperoxy-5-methoxy-6-methyl-1,4-oxazin-2-one Formula: C17H23NO5 MolecularWeight: 321.36822

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=NC(C(=O)O1)(CC2=CC=CC=C2)OO)OC)C(C)(C)C

Isomeric SMILES

C[C@@]1(C(=N[C@](C(=O)O1)(CC2=CC=CC=C2)OO)OC)C(C)(C)C

InChI

InChI=1S/C17H23NO5/c1-15(2,3)16(4)13(21-5)18-17(23-20,14(19)22-16)11-12-9-7-6-8-10-12/h6-10,20H,11H2,1-5H3/t16-,17-/m1/s1