1,2-oxaziridin-3-yl 2-(phenylmethyl)-4-phenylsulfanyl-butanoate

Systemtic Name: 1,2-oxaziridin-3-yl 2-(phenylmethyl)-4-phenylsulfanyl-butanoate Openeye Name: oxaziridin-3-yl 2-benzyl-4-phenylsulfanyl-butanoate CAS Name: 2-(phenylmethyl)-4-(phenylthio)butanoic acid 3-oxaziridinyl ester IUPAC Name: oxaziridin-3-yl 2-benzyl-4-phenylsulfanylbutanoate Traditional Name: 2-benzyl-4-(phenylthio)butyric acid oxaziridin-3-yl ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CCSC2=CC=CC=C2)C(=O)OC3NO3

Isomeric SMILES

C1=CC=C(C=C1)CC(CCSC2=CC=CC=C2)C(=O)OC3NO3

InChI

InChI=1S/C18H19NO3S/c20-17(21-18-19-22-18)15(13-14-7-3-1-4-8-14)11-12-23-16-9-5-2-6-10-16/h1-10,15,18-19H,11-13H2