ethyl 3-(2,6-dimethylmorpholin-4-yl)carbonyl-5-nitro-benzoate

Systemtic Name: ethyl 3-(2,6-dimethylmorpholin-4-yl)carbonyl-5-nitro-benzoate Openeye Name: ethyl 3-(2,6-dimethylmorpholine-4-carbonyl)-5-nitro-benzoate CAS Name: 3-[(2,6-dimethyl-4-morpholinyl)-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-(2,6-dimethylmorpholine-4-carbonyl)-5-nitrobenzoate Traditional Name: 3-(2,6-dimethylmorpholine-4-carbonyl)-5-nitro-benzoic acid ethyl ester Formula: C16H20N2O6 MolecularWeight: 336.3398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CC(OC(C2)C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CC(OC(C2)C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O6/c1-4-23-16(20)13-5-12(6-14(7-13)18(21)22)15(19)17-8-10(2)24-11(3)9-17/h5-7,10-11H,4,8-9H2,1-3H3