3-[butan-2-yl(ethyl)sulfamoyl]-4-methyl-benzoic acid

Systemtic Name: 3-[butan-2-yl(ethyl)sulfamoyl]-4-methyl-benzoic acid Openeye Name: 3-[ethyl(sec-butyl)sulfamoyl]-4-methyl-benzoic acid CAS Name: 3-[butan-2-yl(ethyl)sulfamoyl]-4-methylbenzoic acid IUPAC Name: 3-[butan-2-yl(ethyl)sulfamoyl]-4-methylbenzoic acid Traditional Name: 3-[ethyl(sec-butyl)sulfamoyl]-4-methyl-benzoic acid Formula: C14H21NO4S MolecularWeight: 299.38584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO4S/c1-5-11(4)15(6-2)20(18,19)13-9-12(14(16)17)8-7-10(13)3/h7-9,11H,5-6H2,1-4H3,(H,16,17)