[(2R)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 3-fluoranyl-4-methyl-benzoate

Systemtic Name: [(2R)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 3-fluoranyl-4-methyl-benzoate Openeye Name: [(1R)-2-(isobutylamino)-1-methyl-2-oxo-ethyl] 3-fluoro-4-methyl-benzoate CAS Name: 3-fluoro-4-methylbenzoic acid [(2R)-1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-methylpropylamino)-1-oxopropan-2-yl] 3-fluoro-4-methylbenzoate Traditional Name: 3-fluoro-4-methyl-benzoic acid [(1R)-2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C15H20FNO3 MolecularWeight: 281.322603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NCC(C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O[C@H](C)C(=O)NCC(C)C)F

InChI

InChI=1S/C15H20FNO3/c1-9(2)8-17-14(18)11(4)20-15(19)12-6-5-10(3)13(16)7-12/h5-7,9,11H,8H2,1-4H3,(H,17,18)/t11-/m1/s1