[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] (3R)-3-phenylbutanoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] (3R)-3-phenylbutanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] (3R)-3-phenylbutanoate CAS Name: (3R)-3-phenylbutanoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] (3R)-3-phenylbutanoate Traditional Name: (3R)-3-phenylbutyric acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC(=O)NCCC#N)C1=CC=CC=C1

Isomeric SMILES

C[C@H](CC(=O)OCC(=O)NCCC#N)C1=CC=CC=C1

InChI

InChI=1S/C15H18N2O3/c1-12(13-6-3-2-4-7-13)10-15(19)20-11-14(18)17-9-5-8-16/h2-4,6-7,12H,5,9-11H2,1H3,(H,17,18)/t12-/m1/s1