[2-oxidanylidene-2-(4-phenylbutan-2-ylamino)ethyl] 2-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: [2-oxidanylidene-2-(4-phenylbutan-2-ylamino)ethyl] 2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: [2-[(1-methyl-3-phenyl-propyl)amino]-2-oxo-ethyl] 2-(p-tolylsulfonylamino)propanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]propanoic acid [2-oxo-2-(4-phenylbutan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylbutan-2-ylamino)ethyl] 2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 2-(tosylamino)propionic acid [2-keto-2-[(1-methyl-3-phenyl-propyl)amino]ethyl] ester Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OCC(=O)NC(C)CCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OCC(=O)NC(C)CCC2=CC=CC=C2

InChI

InChI=1S/C22H28N2O5S/c1-16-9-13-20(14-10-16)30(27,28)24-18(3)22(26)29-15-21(25)23-17(2)11-12-19-7-5-4-6-8-19/h4-10,13-14,17-18,24H,11-12,15H2,1-3H3,(H,23,25)