2-propoxy-5-(prop-2-ynylsulfamoyl)benzoic acid

Systemtic Name: 2-propoxy-5-(prop-2-ynylsulfamoyl)benzoic acid Openeye Name: 2-propoxy-5-(prop-2-ynylsulfamoyl)benzoic acid CAS Name: 2-propoxy-5-(prop-2-ynylsulfamoyl)benzoic acid IUPAC Name: 2-propoxy-5-(prop-2-ynylsulfamoyl)benzoic acid Traditional Name: 5-(propargylsulfamoyl)-2-propoxy-benzoic acid Formula: C13H15NO5S MolecularWeight: 297.3269

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)NCC#C)C(=O)O

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)NCC#C)C(=O)O

InChI

InChI=1S/C13H15NO5S/c1-3-7-14-20(17,18)10-5-6-12(19-8-4-2)11(9-10)13(15)16/h1,5-6,9,14H,4,7-8H2,2H3,(H,15,16)