[(2R)-3-methyl-1-[N-(4-methylphenyl)sulfonyl-S-phenyl-sulfonimidoyl]butan-2-yl] methanesulfonate

Systemtic Name: [(2R)-3-methyl-1-[N-(4-methylphenyl)sulfonyl-S-phenyl-sulfonimidoyl]butan-2-yl] methanesulfonate Openeye Name: [(1R)-2-methyl-1-[[S-phenyl-N-(p-tolylsulfonyl)sulfonimidoyl]methyl]propyl] methanesulfonate CAS Name: methanesulfonic acid [(2R)-3-methyl-1-[N-(4-methylphenyl)sulfonyl-S-phenylsulfonimidoyl]butan-2-yl] ester IUPAC Name: [(2R)-3-methyl-1-[N-(4-methylphenyl)sulfonyl-S-phenylsulfonimidoyl]butan-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [(1R)-2-methyl-1-[(S-phenyl-N-tosyl-sulfonimidoyl)methyl]propyl] ester Formula: C19H25NO6S3 MolecularWeight: 459.5999

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=S(=O)(CC(C(C)C)OS(=O)(=O)C)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=[S@@](=O)(C[C@@H](C(C)C)OS(=O)(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C19H25NO6S3/c1-15(2)19(26-27(4,21)22)14-28(23,17-8-6-5-7-9-17)20-29(24,25)18-12-10-16(3)11-13-18/h5-13,15,19H,14H2,1-4H3/t19-,28+/m0/s1