[(2R)-1-[(3-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-4-(4-propoxyphenyl)butanoate

Systemtic Name: [(2R)-1-[(3-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-4-(4-propoxyphenyl)butanoate Openeye Name: [(1R)-2-(3-fluoroanilino)-1-methyl-2-oxo-ethyl] 4-oxo-4-(4-propoxyphenyl)butanoate CAS Name: 4-oxo-4-(4-propoxyphenyl)butanoic acid [(2R)-1-(3-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(3-fluoroanilino)-1-oxopropan-2-yl] 4-oxo-4-(4-propoxyphenyl)butanoate Traditional Name: 4-keto-4-(4-propoxyphenyl)butyric acid [(1R)-2-(3-fluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H24FNO5 MolecularWeight: 401.428063

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)CCC(=O)OC(C)C(=O)NC2=CC(=CC=C2)F

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)CCC(=O)O[C@H](C)C(=O)NC2=CC(=CC=C2)F

InChI

InChI=1S/C22H24FNO5/c1-3-13-28-19-9-7-16(8-10-19)20(25)11-12-21(26)29-15(2)22(27)24-18-6-4-5-17(23)14-18/h4-10,14-15H,3,11-13H2,1-2H3,(H,24,27)/t15-/m1/s1