methyl 2,6-bis[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: methyl 2,6-bis[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: methyl 2,6-bis(p-tolylsulfonylamino)hexanoate CAS Name: 2,6-bis[(4-methylphenyl)sulfonylamino]hexanoic acid methyl ester IUPAC Name: methyl 2,6-bis[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 2,6-bis(tosylamino)hexanoic acid methyl ester Formula: C21H28N2O6S2 MolecularWeight: 468.58682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCCC(C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCCC(C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H28N2O6S2/c1-16-7-11-18(12-8-16)30(25,26)22-15-5-4-6-20(21(24)29-3)23-31(27,28)19-13-9-17(2)10-14-19/h7-14,20,22-23H,4-6,15H2,1-3H3