sodium 2-methoxy-2-[(4-nitrophenyl)methoxycarbonylamino]ethanoate

Systemtic Name: sodium 2-methoxy-2-[(4-nitrophenyl)methoxycarbonylamino]ethanoate Openeye Name: sodium 2-methoxy-2-[(4-nitrophenyl)methoxycarbonylamino]acetate CAS Name: sodium 2-methoxy-2-[[(4-nitrophenyl)methoxy-oxomethyl]amino]acetate IUPAC Name: sodium 2-methoxy-2-[(4-nitrophenyl)methoxycarbonylamino]acetate Traditional Name: sodium 2-methoxy-2-[(4-nitrobenzyl)oxycarbonylamino]acetate Formula: C11H11N2NaO7 MolecularWeight: 306.20401

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Descriptors Computed from Structure

Canonical SMILES:

COC(C(=O)[O-])NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-].[Na+]

Isomeric SMILES

COC(C(=O)[O-])NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-].[Na+]

InChI

InChI=1S/C11H12N2O7.Na/c1-19-9(10(14)15)12-11(16)20-6-7-2-4-8(5-3-7)13(17)18;/h2-5,9H,6H2,1H3,(H,12,16)(H,14,15);/q;+1/p-1