[3-[(4-methylphenyl)sulfonylamino]-2-oxidanyl-propyl] 4-methylbenzenesulfonate

Systemtic Name: [3-[(4-methylphenyl)sulfonylamino]-2-oxidanyl-propyl] 4-methylbenzenesulfonate Openeye Name: [2-hydroxy-3-(p-tolylsulfonylamino)propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-hydroxy-3-[(4-methylphenyl)sulfonylamino]propyl] ester IUPAC Name: [2-hydroxy-3-[(4-methylphenyl)sulfonylamino]propyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-hydroxy-3-(tosylamino)propyl] ester Formula: C17H21NO6S2 MolecularWeight: 399.48174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO6S2/c1-13-3-7-16(8-4-13)25(20,21)18-11-15(19)12-24-26(22,23)17-9-5-14(2)6-10-17/h3-10,15,18-19H,11-12H2,1-2H3