(5-nitroquinolin-8-yl) benzoate

Systemtic Name: (5-nitroquinolin-8-yl) benzoate Openeye Name: (5-nitro-8-quinolyl) benzoate CAS Name: benzoic acid (5-nitro-8-quinolinyl) ester IUPAC Name: (5-nitroquinolin-8-yl) benzoate Traditional Name: benzoic acid (5-nitro-8-quinolyl) ester Formula: C16H10N2O4 MolecularWeight: 294.2616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

InChI

InChI=1S/C16H10N2O4/c19-16(11-5-2-1-3-6-11)22-14-9-8-13(18(20)21)12-7-4-10-17-15(12)14/h1-10H