4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[[(2R,6R)-2,6-dimethyl-4-morpholin-4-iumyl]methyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-2-methoxy-6-nitro-phenolate Formula: C14H20N2O5 MolecularWeight: 296.319

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CC2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-]

Isomeric SMILES

C[C@@H]1C[NH+](C[C@H](O1)C)CC2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H20N2O5/c1-9-6-15(7-10(2)21-9)8-11-4-12(16(18)19)14(17)13(5-11)20-3/h4-5,9-10,17H,6-8H2,1-3H3/t9-,10-/m1/s1