[5,7-bis(bromanyl)quinolin-8-yl] 3-nitrobenzoate

Systemtic Name: [5,7-bis(bromanyl)quinolin-8-yl] 3-nitrobenzoate Openeye Name: (5,7-dibromo-8-quinolyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (5,7-dibromo-8-quinolinyl) ester IUPAC Name: (5,7-dibromoquinolin-8-yl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (5,7-dibromo-8-quinolyl) ester Formula: C16H8Br2N2O4 MolecularWeight: 452.05372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC2=C(C=C(C3=C2N=CC=C3)Br)Br

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC2=C(C=C(C3=C2N=CC=C3)Br)Br

InChI

InChI=1S/C16H8Br2N2O4/c17-12-8-13(18)15(14-11(12)5-2-6-19-14)24-16(21)9-3-1-4-10(7-9)20(22)23/h1-8H