2-[methyl-(4-methylphenyl)sulfonyl-amino]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[methyl-(4-methylphenyl)sulfonyl-amino]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[methyl(p-tolylsulfonyl)amino]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[methyl-(4-methylphenyl)sulfonylamino]ethyl ester IUPAC Name: 2-[methyl-(4-methylphenyl)sulfonylamino]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[methyl(tosyl)amino]ethyl ester Formula: C17H21NO5S2 MolecularWeight: 383.48234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO5S2/c1-14-4-8-16(9-5-14)24(19,20)18(3)12-13-23-25(21,22)17-10-6-15(2)7-11-17/h4-11H,12-13H2,1-3H3