[1-(4-fluorophenyl)carbonyl-2-oxidanylidene-azepan-3-yl] 4-(ethylsulfamoyl)benzoate

Systemtic Name: [1-(4-fluorophenyl)carbonyl-2-oxidanylidene-azepan-3-yl] 4-(ethylsulfamoyl)benzoate Openeye Name: [1-(4-fluorobenzoyl)-2-oxo-azepan-3-yl] 4-(ethylsulfamoyl)benzoate CAS Name: 4-(ethylsulfamoyl)benzoic acid [1-[(4-fluorophenyl)-oxomethyl]-2-oxo-3-azepanyl] ester IUPAC Name: [1-(4-fluorobenzoyl)-2-oxoazepan-3-yl] 4-(ethylsulfamoyl)benzoate Traditional Name: 4-(ethylsulfamoyl)benzoic acid [1-(4-fluorobenzoyl)-2-keto-azepan-3-yl] ester Formula: C22H23FN2O6S MolecularWeight: 462.491223

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)OC2CCCCN(C2=O)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)OC2CCCCN(C2=O)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H23FN2O6S/c1-2-24-32(29,30)18-12-8-16(9-13-18)22(28)31-19-5-3-4-14-25(21(19)27)20(26)15-6-10-17(23)11-7-15/h6-13,19,24H,2-5,14H2,1H3