(2-morpholin-4-yl-2-oxidanylidene-ethyl) 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoate Openeye Name: (2-morpholino-2-oxo-ethyl) 4-methyl-3-(m-tolylsulfamoyl)benzoate CAS Name: 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoate Traditional Name: 4-methyl-3-(m-tolylsulfamoyl)benzoic acid (2-keto-2-morpholino-ethyl) ester Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)N3CCOCC3)C

InChI

InChI=1S/C21H24N2O6S/c1-15-4-3-5-18(12-15)22-30(26,27)19-13-17(7-6-16(19)2)21(25)29-14-20(24)23-8-10-28-11-9-23/h3-7,12-13,22H,8-11,14H2,1-2H3