ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate

Systemtic Name: ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate Openeye Name: ethyl 4-[(5,7-dinitro-8-quinolyl)amino]benzoate CAS Name: 4-[(5,7-dinitro-8-quinolinyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate Traditional Name: 4-[(5,7-dinitro-8-quinolyl)amino]benzoic acid ethyl ester Formula: C18H14N4O6 MolecularWeight: 382.32696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N4O6/c1-2-28-18(23)11-5-7-12(8-6-11)20-17-15(22(26)27)10-14(21(24)25)13-4-3-9-19-16(13)17/h3-10,20H,2H2,1H3