ethyl 3-(2-ethylmorpholin-4-yl)carbonyl-5-nitro-benzoate

Systemtic Name: ethyl 3-(2-ethylmorpholin-4-yl)carbonyl-5-nitro-benzoate Openeye Name: ethyl 3-(2-ethylmorpholine-4-carbonyl)-5-nitro-benzoate CAS Name: 3-[(2-ethyl-4-morpholinyl)-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-(2-ethylmorpholine-4-carbonyl)-5-nitrobenzoate Traditional Name: 3-(2-ethylmorpholine-4-carbonyl)-5-nitro-benzoic acid ethyl ester Formula: C16H20N2O6 MolecularWeight: 336.3398

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCO1)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCC1CN(CCO1)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C16H20N2O6/c1-3-14-10-17(5-6-24-14)15(19)11-7-12(16(20)23-4-2)9-13(8-11)18(21)22/h7-9,14H,3-6,10H2,1-2H3