7-(phenylsulfonylamino)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylic acid

Systemtic Name: 7-(phenylsulfonylamino)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylic acid Openeye Name: 7-(benzenesulfonamido)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylic acid CAS Name: 7-(benzenesulfonamido)-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylic acid IUPAC Name: 7-(benzenesulfonamido)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylic acid Traditional Name: 7-(benzenesulfonamido)-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylic acid Formula: C16H15NO6S MolecularWeight: 349.3584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO6S/c18-16(19)12-9-14-15(23-8-4-7-22-14)10-13(12)17-24(20,21)11-5-2-1-3-6-11/h1-3,5-6,9-10,17H,4,7-8H2,(H,18,19)