5-[(2-oxidanylideneazepan-3-yl)sulfamoyl]furan-2-carboxylic acid

Systemtic Name: 5-[(2-oxidanylideneazepan-3-yl)sulfamoyl]furan-2-carboxylic acid Openeye Name: 5-[(2-oxoazepan-3-yl)sulfamoyl]furan-2-carboxylic acid CAS Name: 5-[(2-oxo-3-azepanyl)sulfamoyl]-2-furancarboxylic acid IUPAC Name: 5-[(2-oxoazepan-3-yl)sulfamoyl]furan-2-carboxylic acid Traditional Name: 5-[(2-ketoazepan-3-yl)sulfamoyl]-2-furoic acid Formula: C11H14N2O6S MolecularWeight: 302.30366

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NS(=O)(=O)C2=CC=C(O2)C(=O)O

Isomeric SMILES

C1CCNC(=O)C(C1)NS(=O)(=O)C2=CC=C(O2)C(=O)O

InChI

InChI=1S/C11H14N2O6S/c14-10-7(3-1-2-6-12-10)13-20(17,18)9-5-4-8(19-9)11(15)16/h4-5,7,13H,1-3,6H2,(H,12,14)(H,15,16)