[(1S)-1-(2-fluorophenyl)-2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] furan-2-carboxylate

Systemtic Name: [(1S)-1-(2-fluorophenyl)-2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] furan-2-carboxylate Openeye Name: [(1S)-2-(1,1-dimethylpropylamino)-1-(2-fluorophenyl)-2-oxo-ethyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [(1S)-1-(2-fluorophenyl)-2-(2-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [(1S)-1-(2-fluorophenyl)-2-(2-methylbutan-2-ylamino)-2-oxoethyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [(1S)-2-(tert-amylamino)-1-(2-fluorophenyl)-2-keto-ethyl] ester Formula: C18H20FNO4 MolecularWeight: 333.354103

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C(C1=CC=CC=C1F)OC(=O)C2=CC=CO2

Isomeric SMILES

CCC(C)(C)NC(=O)[C@H](C1=CC=CC=C1F)OC(=O)C2=CC=CO2

InChI

InChI=1S/C18H20FNO4/c1-4-18(2,3)20-16(21)15(12-8-5-6-9-13(12)19)24-17(22)14-10-7-11-23-14/h5-11,15H,4H2,1-3H3,(H,20,21)/t15-/m0/s1