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

Systemtic Name: [3-[(4-methylphenyl)sulfonylamino]-2-(4-methylphenyl)sulfonyloxy-propyl] 4-methylbenzenesulfonate Openeye Name: [3-(p-tolylsulfonylamino)-2-(p-tolylsulfonyloxy)propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-[(4-methylphenyl)sulfonylamino]-2-(4-methylphenyl)sulfonyloxypropyl] ester IUPAC Name: [3-[(4-methylphenyl)sulfonylamino]-2-(4-methylphenyl)sulfonyloxypropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-(tosylamino)-2-tosyloxy-propyl] ester Formula: C24H27NO8S3 MolecularWeight: 553.66808

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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)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(COS(=O)(=O)C2=CC=C(C=C2)C)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H27NO8S3/c1-18-4-10-22(11-5-18)34(26,27)25-16-21(33-36(30,31)24-14-8-20(3)9-15-24)17-32-35(28,29)23-12-6-19(2)7-13-23/h4-15,21,25H,16-17H2,1-3H3