3-pentoxy-4-(phenylsulfamoyl)benzoic acid

Systemtic Name: 3-pentoxy-4-(phenylsulfamoyl)benzoic acid Openeye Name: 3-pentoxy-4-(phenylsulfamoyl)benzoic acid CAS Name: 3-pentoxy-4-(phenylsulfamoyl)benzoic acid IUPAC Name: 3-pentoxy-4-(phenylsulfamoyl)benzoic acid Traditional Name: 3-amoxy-4-(phenylsulfamoyl)benzoic acid Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC(=C1)C(=O)O)S(=O)(=O)NC2=CC=CC=C2

Isomeric SMILES

CCCCCOC1=C(C=CC(=C1)C(=O)O)S(=O)(=O)NC2=CC=CC=C2

InChI

InChI=1S/C18H21NO5S/c1-2-3-7-12-24-16-13-14(18(20)21)10-11-17(16)25(22,23)19-15-8-5-4-6-9-15/h4-6,8-11,13,19H,2-3,7,12H2,1H3,(H,20,21)