3-[(4-acetyloxy-3-oxidanylidene-butyl)amino]-4-phenoxy-5-sulfamoyl-benzoic acid

Systemtic Name: 3-[(4-acetyloxy-3-oxidanylidene-butyl)amino]-4-phenoxy-5-sulfamoyl-benzoic acid Openeye Name: 3-[(4-acetoxy-3-oxo-butyl)amino]-4-phenoxy-5-sulfamoyl-benzoic acid CAS Name: 3-[(4-acetyloxy-3-oxobutyl)amino]-4-phenoxy-5-sulfamoylbenzoic acid IUPAC Name: 3-[(4-acetyloxy-3-oxobutyl)amino]-4-phenoxy-5-sulfamoylbenzoic acid Traditional Name: 3-[(4-acetoxy-3-keto-butyl)amino]-4-phenoxy-5-sulfamoyl-benzoic acid Formula: C19H20N2O8S MolecularWeight: 436.4357

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=O)CCNC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N)OC2=CC=CC=C2

Isomeric SMILES

CC(=O)OCC(=O)CCNC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N)OC2=CC=CC=C2

InChI

InChI=1S/C19H20N2O8S/c1-12(22)28-11-14(23)7-8-21-16-9-13(19(24)25)10-17(30(20,26)27)18(16)29-15-5-3-2-4-6-15/h2-6,9-10,21H,7-8,11H2,1H3,(H,24,25)(H2,20,26,27)