3-[(2-azanyl-2-oxidanylidene-ethyl)-propan-2-yl-sulfamoyl]-4-methyl-benzoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N(CC(=O)N)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N(CC(=O)N)C(C)C

InChI

InChI=1S/C13H18N2O5S/c1-8(2)15(7-12(14)16)21(19,20)11-6-10(13(17)18)5-4-9(11)3/h4-6,8H,7H2,1-3H3,(H2,14,16)(H,17,18)