2-(3-nitrophenyl)quinoline-4-carboxylate

Systemtic Name: 2-(3-nitrophenyl)quinoline-4-carboxylate Openeye Name: 2-(3-nitrophenyl)quinoline-4-carboxylate CAS Name: 2-(3-nitrophenyl)-4-quinolinecarboxylate IUPAC Name: 2-(3-nitrophenyl)quinoline-4-carboxylate Traditional Name: 2-(3-nitrophenyl)cinchoninate Formula: C16H9N2O4- MolecularWeight: 293.25366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C16H10N2O4/c19-16(20)13-9-15(17-14-7-2-1-6-12(13)14)10-4-3-5-11(8-10)18(21)22/h1-9H,(H,19,20)/p-1