2-(3-nitrophenyl)quinoline-4-carboxylic acid

Systemtic Name: 2-(3-nitrophenyl)quinoline-4-carboxylic acid Openeye Name: 2-(3-nitrophenyl)quinoline-4-carboxylic acid CAS Name: 2-(3-nitrophenyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(3-nitrophenyl)quinoline-4-carboxylic acid Traditional Name: 2-(3-nitrophenyl)cinchoninic acid Formula: C16H10N2O4 MolecularWeight: 294.2616

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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)