[1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(phenylsulfonyl)propanoate

Systemtic Name: [1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(phenylsulfonyl)propanoate Openeye Name: [2-(2-fluoroanilino)-1-methyl-2-oxo-ethyl] 3-(benzenesulfonyl)propanoate CAS Name: 3-(benzenesulfonyl)propanoic acid [1-(2-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-fluoroanilino)-1-oxopropan-2-yl] 3-(benzenesulfonyl)propanoate Traditional Name: 3-besylpropionic acid [2-(2-fluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C18H18FNO5S MolecularWeight: 379.402623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1F)OC(=O)CCS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1F)OC(=O)CCS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H18FNO5S/c1-13(18(22)20-16-10-6-5-9-15(16)19)25-17(21)11-12-26(23,24)14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3,(H,20,22)