[2-[(1-methoxy-3-methyl-1-oxidanylidene-pentan-2-yl)amino]-2-oxidanylidene-ethyl] 2-fluoranyl-5-sulfamoyl-benzoate

Systemtic Name: [2-[(1-methoxy-3-methyl-1-oxidanylidene-pentan-2-yl)amino]-2-oxidanylidene-ethyl] 2-fluoranyl-5-sulfamoyl-benzoate Openeye Name: [2-[(1-methoxycarbonyl-2-methyl-butyl)amino]-2-oxo-ethyl] 2-fluoro-5-sulfamoyl-benzoate CAS Name: 2-fluoro-5-sulfamoylbenzoic acid [2-[(1-methoxy-3-methyl-1-oxopentan-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-methoxy-3-methyl-1-oxopentan-2-yl)amino]-2-oxoethyl] 2-fluoro-5-sulfamoylbenzoate Traditional Name: 2-fluoro-5-sulfamoyl-benzoic acid [2-[(1-carbomethoxy-2-methyl-butyl)amino]-2-keto-ethyl] ester Formula: C16H21FN2O7S MolecularWeight: 404.410543

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)F

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)F

InChI

InChI=1S/C16H21FN2O7S/c1-4-9(2)14(16(22)25-3)19-13(20)8-26-15(21)11-7-10(27(18,23)24)5-6-12(11)17/h5-7,9,14H,4,8H2,1-3H3,(H,19,20)(H2,18,23,24)