dimethyl 5-(6-methoxy-5-nitro-quinolin-2-yl)-1,2,4-triazine-3,6-dicarboxylate

Systemtic Name: dimethyl 5-(6-methoxy-5-nitro-quinolin-2-yl)-1,2,4-triazine-3,6-dicarboxylate Openeye Name: dimethyl 5-(6-methoxy-5-nitro-2-quinolyl)-1,2,4-triazine-3,6-dicarboxylate CAS Name: 5-(6-methoxy-5-nitro-2-quinolinyl)-1,2,4-triazine-3,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(6-methoxy-5-nitroquinolin-2-yl)-1,2,4-triazine-3,6-dicarboxylate Traditional Name: 5-(6-methoxy-5-nitro-2-quinolyl)-1,2,4-triazine-3,6-dicarboxylic acid dimethyl ester Formula: C17H13N5O7 MolecularWeight: 399.31442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)N=C(C=C2)C3=C(N=NC(=N3)C(=O)OC)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C2=C(C=C1)N=C(C=C2)C3=C(N=NC(=N3)C(=O)OC)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O7/c1-27-11-7-6-9-8(14(11)22(25)26)4-5-10(18-9)12-13(16(23)28-2)20-21-15(19-12)17(24)29-3/h4-7H,1-3H3