[(3R)-1-(4-cyanophenyl)-2-oxidanylidene-pyrrolidin-3-yl]azanium; (2S)-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: [(3R)-1-(4-cyanophenyl)-2-oxidanylidene-pyrrolidin-3-yl]azanium; (2S)-2-oxidanyl-2-phenyl-ethanoate Openeye Name: [(3R)-1-(4-cyanophenyl)-2-oxo-pyrrolidin-3-yl]ammonium; (2S)-2-hydroxy-2-phenyl-acetate CAS Name: [(3R)-1-(4-cyanophenyl)-2-oxo-3-pyrrolidinyl]ammonium; (2S)-2-hydroxy-2-phenylacetate IUPAC Name: [(3R)-1-(4-cyanophenyl)-2-oxopyrrolidin-3-yl]azanium; (2S)-2-hydroxy-2-phenylacetate Traditional Name: [(3R)-1-(4-cyanophenyl)-2-keto-pyrrolidin-3-yl]ammonium; (2S)-2-hydroxy-2-phenyl-acetate Formula: C19H19N3O4 MolecularWeight: 353.37186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1[NH3+])C2=CC=C(C=C2)C#N.C1=CC=C(C=C1)C(C(=O)[O-])O

Isomeric SMILES

C1CN(C(=O)[C@@H]1[NH3+])C2=CC=C(C=C2)C#N.C1=CC=C(C=C1)[C@@H](C(=O)[O-])O

InChI

InChI=1S/C11H11N3O.C8H8O3/c12-7-8-1-3-9(4-2-8)14-6-5-10(13)11(14)15;9-7(8(10)11)6-4-2-1-3-5-6/h1-4,10H,5-6,13H2;1-5,7,9H,(H,10,11)/t10-;7-/m10/s1