2-[2-(5-nitrofuran-2-yl)ethenyl]quinoline-4-carboxylic acid; sodium

Systemtic Name: 2-[2-(5-nitrofuran-2-yl)ethenyl]quinoline-4-carboxylic acid; sodium Openeye Name: 2-[2-(5-nitro-2-furyl)vinyl]quinoline-4-carboxylic acid; sodium CAS Name: 2-[2-(5-nitro-2-furanyl)ethenyl]-4-quinolinecarboxylic acid; sodium IUPAC Name: 2-[2-(5-nitrofuran-2-yl)ethenyl]quinoline-4-carboxylic acid; sodium Traditional Name: 2-[2-(5-nitro-2-furyl)vinyl]cinchoninic acid; sodium Formula: C16H10N2NaO5 MolecularWeight: 333.25077

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C=CC3=CC=C(O3)[N+](=O)[O-])C(=O)O.[Na]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C=CC3=CC=C(O3)[N+](=O)[O-])C(=O)O.[Na]

InChI

InChI=1S/C16H10N2O5.Na/c19-16(20)13-9-10(17-14-4-2-1-3-12(13)14)5-6-11-7-8-15(23-11)18(21)22;/h1-9H,(H,19,20);