methyl 4-[[(2-methoxy-2-oxidanylidene-ethyl)amino]methyl]-3-nitro-benzoate

Systemtic Name: methyl 4-[[(2-methoxy-2-oxidanylidene-ethyl)amino]methyl]-3-nitro-benzoate Openeye Name: methyl 4-[[(2-methoxy-2-oxo-ethyl)amino]methyl]-3-nitro-benzoate CAS Name: 4-[[(2-methoxy-2-oxoethyl)amino]methyl]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[[(2-methoxy-2-oxoethyl)amino]methyl]-3-nitrobenzoate Traditional Name: 4-[[(2-keto-2-methoxy-ethyl)amino]methyl]-3-nitro-benzoic acid methyl ester Formula: C12H14N2O6 MolecularWeight: 282.24936

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNCC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CNCC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O6/c1-19-11(15)7-13-6-9-4-3-8(12(16)20-2)5-10(9)14(17)18/h3-5,13H,6-7H2,1-2H3