[(2R)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 1-(4-fluorophenyl)cyclopentane-1-carboxylate

Systemtic Name: [(2R)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 1-(4-fluorophenyl)cyclopentane-1-carboxylate Openeye Name: [(1R)-2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl] 1-(4-fluorophenyl)cyclopentanecarboxylate CAS Name: 1-(4-fluorophenyl)-1-cyclopentanecarboxylic acid [(2R)-1-(2-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-cyanoanilino)-1-oxopropan-2-yl] 1-(4-fluorophenyl)cyclopentane-1-carboxylate Traditional Name: 1-(4-fluorophenyl)cyclopentanecarboxylic acid [(1R)-2-(2-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H21FN2O3 MolecularWeight: 380.412143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C#N)OC(=O)C2(CCCC2)C3=CC=C(C=C3)F

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C#N)OC(=O)C2(CCCC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H21FN2O3/c1-15(20(26)25-19-7-3-2-6-16(19)14-24)28-21(27)22(12-4-5-13-22)17-8-10-18(23)11-9-17/h2-3,6-11,15H,4-5,12-13H2,1H3,(H,25,26)/t15-/m1/s1