[3-[methyl-(4-methylphenyl)sulfonyl-amino]-2-oxidanyl-2-phenyl-propyl] methanesulfonate

Systemtic Name: [3-[methyl-(4-methylphenyl)sulfonyl-amino]-2-oxidanyl-2-phenyl-propyl] methanesulfonate Openeye Name: [2-hydroxy-3-[methyl(p-tolylsulfonyl)amino]-2-phenyl-propyl] methanesulfonate CAS Name: methanesulfonic acid [2-hydroxy-3-[methyl-(4-methylphenyl)sulfonylamino]-2-phenylpropyl] ester IUPAC Name: [2-hydroxy-3-[methyl-(4-methylphenyl)sulfonylamino]-2-phenylpropyl] methanesulfonate Traditional Name: methanesulfonic acid [2-hydroxy-3-[methyl(tosyl)amino]-2-phenyl-propyl] ester Formula: C18H23NO6S2 MolecularWeight: 413.50832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO6S2/c1-15-9-11-17(12-10-15)27(23,24)19(2)13-18(20,14-25-26(3,21)22)16-7-5-4-6-8-16/h4-12,20H,13-14H2,1-3H3