4-[[3-(3-ethoxy-2-oxidanyl-propoxy)-4-methoxy-phenyl]carbonylsulfamoyl]benzoic acid

Systemtic Name: 4-[[3-(3-ethoxy-2-oxidanyl-propoxy)-4-methoxy-phenyl]carbonylsulfamoyl]benzoic acid Openeye Name: 4-[[3-(3-ethoxy-2-hydroxy-propoxy)-4-methoxy-benzoyl]sulfamoyl]benzoic acid CAS Name: 4-[[[3-(3-ethoxy-2-hydroxypropoxy)-4-methoxyphenyl]-oxomethyl]sulfamoyl]benzoic acid IUPAC Name: 4-[[3-(3-ethoxy-2-hydroxypropoxy)-4-methoxybenzoyl]sulfamoyl]benzoic acid Traditional Name: 4-[[3-(3-ethoxy-2-hydroxy-propoxy)-4-methoxy-benzoyl]sulfamoyl]benzoic acid Formula: C20H23NO9S MolecularWeight: 453.46292

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(COC1=C(C=CC(=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)C(=O)O)OC)O

Isomeric SMILES

CCOCC(COC1=C(C=CC(=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)C(=O)O)OC)O

InChI

InChI=1S/C20H23NO9S/c1-3-29-11-15(22)12-30-18-10-14(6-9-17(18)28-2)19(23)21-31(26,27)16-7-4-13(5-8-16)20(24)25/h4-10,15,22H,3,11-12H2,1-2H3,(H,21,23)(H,24,25)