methyl 2-[(6-nitroquinolin-2-yl)amino]ethanoate

Systemtic Name: methyl 2-[(6-nitroquinolin-2-yl)amino]ethanoate Openeye Name: methyl 2-[(6-nitro-2-quinolyl)amino]acetate CAS Name: 2-[(6-nitro-2-quinolinyl)amino]acetic acid methyl ester IUPAC Name: methyl 2-[(6-nitroquinolin-2-yl)amino]acetate Traditional Name: 2-[(6-nitro-2-quinolyl)amino]acetic acid methyl ester Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC1=NC2=C(C=C1)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CNC1=NC2=C(C=C1)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O4/c1-19-12(16)7-13-11-5-2-8-6-9(15(17)18)3-4-10(8)14-11/h2-6H,7H2,1H3,(H,13,14)