[2-oxidanylidene-5-pyridin-3-yl-1-(trideuteriomethyl)pyrrolidin-3-yl] benzoate

Systemtic Name: [2-oxidanylidene-5-pyridin-3-yl-1-(trideuteriomethyl)pyrrolidin-3-yl] benzoate Openeye Name: [2-oxo-5-(3-pyridyl)-1-(trideuteriomethyl)pyrrolidin-3-yl] benzoate CAS Name: benzoic acid [2-oxo-5-(3-pyridinyl)-1-(trideuteriomethyl)-3-pyrrolidinyl] ester IUPAC Name: [2-oxo-5-pyridin-3-yl-1-(trideuteriomethyl)pyrrolidin-3-yl] benzoate Traditional Name: benzoic acid [2-keto-5-(3-pyridyl)-1-(trideuteriomethyl)pyrrolidin-3-yl] ester Formula: C17H16N2O3 MolecularWeight: 299.339025

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(CC(C1=O)OC(=O)C2=CC=CC=C2)C3=CN=CC=C3

Isomeric SMILES

[2H]C([2H])([2H])N1C(CC(C1=O)OC(=O)C2=CC=CC=C2)C3=CN=CC=C3

InChI

InChI=1S/C17H16N2O3/c1-19-14(13-8-5-9-18-11-13)10-15(16(19)20)22-17(21)12-6-3-2-4-7-12/h2-9,11,14-15H,10H2,1H3/i1D3