2-(butylamino)-4-phenoxy-5-sulfamoyl-benzoic acid

Systemtic Name: 2-(butylamino)-4-phenoxy-5-sulfamoyl-benzoic acid Openeye Name: 2-(butylamino)-4-phenoxy-5-sulfamoyl-benzoic acid CAS Name: 2-(butylamino)-4-phenoxy-5-sulfamoylbenzoic acid IUPAC Name: 2-(butylamino)-4-phenoxy-5-sulfamoylbenzoic acid Traditional Name: 2-(butylamino)-4-phenoxy-5-sulfamoyl-benzoic acid Formula: C17H20N2O5S MolecularWeight: 364.4161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC(=C(C=C1C(=O)O)S(=O)(=O)N)OC2=CC=CC=C2

Isomeric SMILES

CCCCNC1=CC(=C(C=C1C(=O)O)S(=O)(=O)N)OC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O5S/c1-2-3-9-19-14-11-15(24-12-7-5-4-6-8-12)16(25(18,22)23)10-13(14)17(20)21/h4-8,10-11,19H,2-3,9H2,1H3,(H,20,21)(H2,18,22,23)