[(2R)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] benzoate

Systemtic Name: [(2R)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] benzoate Openeye Name: [(1R)-2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl] benzoate CAS Name: benzoic acid [(2R)-1-(2-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-cyanoanilino)-1-oxopropan-2-yl] benzoate Traditional Name: benzoic acid [(1R)-2-(2-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C17H14N2O3 MolecularWeight: 294.30466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O3/c1-12(22-17(21)13-7-3-2-4-8-13)16(20)19-15-10-6-5-9-14(15)11-18/h2-10,12H,1H3,(H,19,20)/t12-/m1/s1