3-[ethyl-[2-(methylamino)-2-oxidanylidene-ethyl]sulfamoyl]-4-methyl-benzoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)O)C

Isomeric SMILES

CCN(CC(=O)NC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)O)C

InChI

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