methyl 2-[2-(3-nitrophenoxy)ethanoylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[2-(3-nitrophenoxy)ethanoylamino]-3-oxidanyl-propanoate Openeye Name: methyl 3-hydroxy-2-[[2-(3-nitrophenoxy)acetyl]amino]propanoate CAS Name: 3-hydroxy-2-[[2-(3-nitrophenoxy)-1-oxoethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[[2-(3-nitrophenoxy)acetyl]amino]propanoate Traditional Name: 3-hydroxy-2-[[2-(3-nitrophenoxy)acetyl]amino]propionic acid methyl ester Formula: C12H14N2O7 MolecularWeight: 298.24876

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)COC1=CC=CC(=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CO)NC(=O)COC1=CC=CC(=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O7/c1-20-12(17)10(6-15)13-11(16)7-21-9-4-2-3-8(5-9)14(18)19/h2-5,10,15H,6-7H2,1H3,(H,13,16)