ethyl 6-[(4-methylphenyl)sulfonylamino]-2-(phenylsulfonylamino)hexanoate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H28N2O6S2/c1-3-29-21(24)20(23-31(27,28)18-9-5-4-6-10-18)11-7-8-16-22-30(25,26)19-14-12-17(2)13-15-19/h4-6,9-10,12-15,20,22-23H,3,7-8,11,16H2,1-2H3