3-[[1-(ethylamino)-1-oxidanylidene-propan-2-yl]sulfamoyl]-4-methyl-benzoic acid

Systemtic Name: 3-[[1-(ethylamino)-1-oxidanylidene-propan-2-yl]sulfamoyl]-4-methyl-benzoic acid Openeye Name: 3-[[2-(ethylamino)-1-methyl-2-oxo-ethyl]sulfamoyl]-4-methyl-benzoic acid CAS Name: 3-[[1-(ethylamino)-1-oxopropan-2-yl]sulfamoyl]-4-methylbenzoic acid IUPAC Name: 3-[[1-(ethylamino)-1-oxopropan-2-yl]sulfamoyl]-4-methylbenzoic acid Traditional Name: 3-[[2-(ethylamino)-2-keto-1-methyl-ethyl]sulfamoyl]-4-methyl-benzoic acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O5S/c1-4-14-12(16)9(3)15-21(19,20)11-7-10(13(17)18)6-5-8(11)2/h5-7,9,15H,4H2,1-3H3,(H,14,16)(H,17,18)