[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 3-(diethylsulfamoyl)-4-fluoranyl-benzoate

Systemtic Name: [2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 3-(diethylsulfamoyl)-4-fluoranyl-benzoate Openeye Name: [2-(3-nitroanilino)-2-oxo-ethyl] 3-(diethylsulfamoyl)-4-fluoro-benzoate CAS Name: 3-(diethylsulfamoyl)-4-fluorobenzoic acid [2-(3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-nitroanilino)-2-oxoethyl] 3-(diethylsulfamoyl)-4-fluorobenzoate Traditional Name: 3-(diethylsulfamoyl)-4-fluoro-benzoic acid [2-keto-2-(3-nitroanilino)ethyl] ester Formula: C19H20FN3O7S MolecularWeight: 453.441403

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])F

InChI

InChI=1S/C19H20FN3O7S/c1-3-22(4-2)31(28,29)17-10-13(8-9-16(17)20)19(25)30-12-18(24)21-14-6-5-7-15(11-14)23(26)27/h5-11H,3-4,12H2,1-2H3,(H,21,24)