[(1S)-2-(diethylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-cyanobenzoate

Systemtic Name: [(1S)-2-(diethylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-cyanobenzoate Openeye Name: [(1S)-2-(diethylamino)-2-oxo-1-phenyl-ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [(1S)-2-(diethylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(diethylamino)-2-oxo-1-phenylethyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [(1S)-2-(diethylamino)-2-keto-1-phenyl-ethyl] ester Formula: C20H20N2O3 MolecularWeight: 336.3844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C1=CC=CC=C1)OC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CCN(CC)C(=O)[C@H](C1=CC=CC=C1)OC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C20H20N2O3/c1-3-22(4-2)19(23)18(16-10-6-5-7-11-16)25-20(24)17-12-8-9-15(13-17)14-21/h5-13,18H,3-4H2,1-2H3/t18-/m0/s1