(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) 4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate

Systemtic Name: (1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) 4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate Openeye Name: (1-methyl-2-morpholino-2-oxo-ethyl) 4-[methyl(p-tolylsulfonyl)amino]benzoate CAS Name: 4-[methyl-(4-methylphenyl)sulfonylamino]benzoic acid [1-(4-morpholinyl)-1-oxopropan-2-yl] ester IUPAC Name: (1-morpholin-4-yl-1-oxopropan-2-yl) 4-[methyl-(4-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-[methyl(tosyl)amino]benzoic acid (2-keto-1-methyl-2-morpholino-ethyl) ester Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)OC(C)C(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)OC(C)C(=O)N3CCOCC3

InChI

InChI=1S/C22H26N2O6S/c1-16-4-10-20(11-5-16)31(27,28)23(3)19-8-6-18(7-9-19)22(26)30-17(2)21(25)24-12-14-29-15-13-24/h4-11,17H,12-15H2,1-3H3