2-methyl-5-(2-methyl-1-oxidanyl-propyl)-4-(phenylmethyl)-2-phenylperoxysulfanyl-7-oxa-4-azabicyclo[3.2.0]heptane-3,6-dione

Systemtic Name: 2-methyl-5-(2-methyl-1-oxidanyl-propyl)-4-(phenylmethyl)-2-phenylperoxysulfanyl-7-oxa-4-azabicyclo[3.2.0]heptane-3,6-dione Openeye Name: 4-benzyl-5-(1-hydroxy-2-methyl-propyl)-2-methyl-2-phenylperoxysulfanyl-7-oxa-4-azabicyclo[3.2.0]heptane-3,6-dione CAS Name: 5-(1-hydroxy-2-methylpropyl)-2-methyl-3,6-dioxo-4-(phenylmethyl)-7-oxa-4-azabicyclo[3.2.0]heptane-2-sulfenic acid phenoxy ester IUPAC Name: 4-benzyl-5-(1-hydroxy-2-methylpropyl)-2-methyl-2-phenylperoxysulfanyl-7-oxa-4-azabicyclo[3.2.0]heptane-3,6-dione Traditional Name: 4-benzyl-5-(1-hydroxy-2-methyl-propyl)-2-methyl-2-(phenylperoxythio)-7-oxa-4-azabicyclo[3.2.0]heptane-3,6-quinone Formula: C23H25NO6S MolecularWeight: 443.5127

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C12C(C(C(=O)N1CC3=CC=CC=C3)(C)SOOC4=CC=CC=C4)OC2=O)O

Isomeric SMILES

CC(C)C(C12C(C(C(=O)N1CC3=CC=CC=C3)(C)SOOC4=CC=CC=C4)OC2=O)O

InChI

InChI=1S/C23H25NO6S/c1-15(2)18(25)23-19(28-21(23)27)22(3,31-30-29-17-12-8-5-9-13-17)20(26)24(23)14-16-10-6-4-7-11-16/h4-13,15,18-19,25H,14H2,1-3H3