methyl 4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)-3-nitro-benzoate

Systemtic Name: methyl 4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)-3-nitro-benzoate Openeye Name: methyl 4-(2-morpholino-2-oxo-ethoxy)-3-nitro-benzoate CAS Name: 4-[2-(4-morpholinyl)-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-(2-morpholin-4-yl-2-oxoethoxy)-3-nitrobenzoate Traditional Name: 4-(2-keto-2-morpholino-ethoxy)-3-nitro-benzoic acid methyl ester Formula: C14H16N2O7 MolecularWeight: 324.28604

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCC(=O)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCC(=O)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O7/c1-21-14(18)10-2-3-12(11(8-10)16(19)20)23-9-13(17)15-4-6-22-7-5-15/h2-3,8H,4-7,9H2,1H3