(5-chloranylquinolin-8-yl) 3,5-dinitrobenzoate

Systemtic Name: (5-chloranylquinolin-8-yl) 3,5-dinitrobenzoate Openeye Name: (5-chloro-8-quinolyl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (5-chloro-8-quinolinyl) ester IUPAC Name: (5-chloroquinolin-8-yl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (5-chloro-8-quinolyl) ester Formula: C16H8ClN3O6 MolecularWeight: 373.70422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C16H8ClN3O6/c17-13-3-4-14(15-12(13)2-1-5-18-15)26-16(21)9-6-10(19(22)23)8-11(7-9)20(24)25/h1-8H