(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C17H21N3O6 MolecularWeight: 363.36514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

C1CCN(C1)C(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C17H21N3O6/c21-16(19-5-1-2-6-19)12-26-17(22)14-11-13(20(23)24)3-4-15(14)18-7-9-25-10-8-18/h3-4,11H,1-2,5-10,12H2