(5-chloranylquinolin-8-yl) 3-nitrobenzoate

Systemtic Name: (5-chloranylquinolin-8-yl) 3-nitrobenzoate Openeye Name: (5-chloro-8-quinolyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (5-chloro-8-quinolinyl) ester IUPAC Name: (5-chloroquinolin-8-yl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (5-chloro-8-quinolyl) ester Formula: C16H9ClN2O4 MolecularWeight: 328.70666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H9ClN2O4/c17-13-6-7-14(15-12(13)5-2-8-18-15)23-16(20)10-3-1-4-11(9-10)19(21)22/h1-9H