[1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-(tert-butylsulfamoyl)-4-methoxy-benzoate

Systemtic Name: [1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-(tert-butylsulfamoyl)-4-methoxy-benzoate Openeye Name: [2-[(4-fluorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 3-(tert-butylsulfamoyl)-4-methoxy-benzoate CAS Name: 3-(tert-butylsulfamoyl)-4-methoxybenzoic acid [1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] 3-(tert-butylsulfamoyl)-4-methoxybenzoate Traditional Name: 3-(tert-butylsulfamoyl)-4-methoxy-benzoic acid [2-[(4-fluorobenzyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C22H27FN2O6S MolecularWeight: 466.522983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)F)OC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)NC(C)(C)C

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)F)OC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)NC(C)(C)C

InChI

InChI=1S/C22H27FN2O6S/c1-14(20(26)24-13-15-6-9-17(23)10-7-15)31-21(27)16-8-11-18(30-5)19(12-16)32(28,29)25-22(2,3)4/h6-12,14,25H,13H2,1-5H3,(H,24,26)