[2-(tert-butylamino)-2-oxidanylidene-ethyl] 3-[(5-fluoranyl-2-methyl-phenyl)sulfonylamino]benzoate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 3-[(5-fluoranyl-2-methyl-phenyl)sulfonylamino]benzoate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 3-[(5-fluoro-2-methyl-phenyl)sulfonylamino]benzoate CAS Name: 3-[(5-fluoro-2-methylphenyl)sulfonylamino]benzoic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 3-[(5-fluoro-2-methylphenyl)sulfonylamino]benzoate Traditional Name: 3-[(5-fluoro-2-methyl-phenyl)sulfonylamino]benzoic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C20H23FN2O5S MolecularWeight: 422.470423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)S(=O)(=O)NC2=CC=CC(=C2)C(=O)OCC(=O)NC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)F)S(=O)(=O)NC2=CC=CC(=C2)C(=O)OCC(=O)NC(C)(C)C

InChI

InChI=1S/C20H23FN2O5S/c1-13-8-9-15(21)11-17(13)29(26,27)23-16-7-5-6-14(10-16)19(25)28-12-18(24)22-20(2,3)4/h5-11,23H,12H2,1-4H3,(H,22,24)