2-[(5,7-dinitroquinolin-8-yl)amino]benzoate

Systemtic Name: 2-[(5,7-dinitroquinolin-8-yl)amino]benzoate Openeye Name: 2-[(5,7-dinitro-8-quinolyl)amino]benzoate CAS Name: 2-[(5,7-dinitro-8-quinolinyl)amino]benzoate IUPAC Name: 2-[(5,7-dinitroquinolin-8-yl)amino]benzoate Traditional Name: 2-[(5,7-dinitro-8-quinolyl)amino]benzoate Formula: C16H9N4O6- MolecularWeight: 353.26586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])NC2=C(C=C(C3=C2N=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])NC2=C(C=C(C3=C2N=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H10N4O6/c21-16(22)9-4-1-2-6-11(9)18-15-13(20(25)26)8-12(19(23)24)10-5-3-7-17-14(10)15/h1-8,18H,(H,21,22)/p-1