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

Systemtic Name: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinoline-4-carboxylic acid Openeye Name: 2-[(E)-2-(5-nitro-2-furyl)vinyl]quinoline-4-carboxylic acid CAS Name: 2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinoline-4-carboxylic acid Traditional Name: 2-[(E)-2-(5-nitro-2-furyl)vinyl]cinchoninic acid Formula: C16H10N2O5 MolecularWeight: 310.261

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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

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)/C=C/C3=CC=C(O3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C16H10N2O5/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)/b6-5+