ethyl 4-[[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]sulfamoyl]benzoate

Systemtic Name: ethyl 4-[[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]sulfamoyl]benzoate Openeye Name: ethyl 4-[[(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl]sulfamoyl]benzoate CAS Name: 4-[[(2S)-1-(ethylamino)-1-oxopropan-2-yl]sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(2S)-1-(ethylamino)-1-oxopropan-2-yl]sulfamoyl]benzoate Traditional Name: 4-[[(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl]sulfamoyl]benzoic acid ethyl ester Formula: C14H20N2O5S MolecularWeight: 328.384

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC

Isomeric SMILES

CCNC(=O)[C@H](C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC

InChI

InChI=1S/C14H20N2O5S/c1-4-15-13(17)10(3)16-22(19,20)12-8-6-11(7-9-12)14(18)21-5-2/h6-10,16H,4-5H2,1-3H3,(H,15,17)/t10-/m0/s1