4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfamoyl)benzoic acid

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfamoyl)benzoic acid Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfamoyl)benzoic acid CAS Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfamoyl)benzoic acid IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfamoyl)benzoic acid Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfamoyl)benzoic acid Formula: C16H15NO6S MolecularWeight: 349.3584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)O)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)O)OC1

InChI

InChI=1S/C16H15NO6S/c18-16(19)11-2-5-13(6-3-11)24(20,21)17-12-4-7-14-15(10-12)23-9-1-8-22-14/h2-7,10,17H,1,8-9H2,(H,18,19)