4-[(E)-2-(5-ethanoyl-8-oxidanyl-quinolin-2-yl)ethenyl]-3-nitro-benzoic acid

Systemtic Name: 4-[(E)-2-(5-ethanoyl-8-oxidanyl-quinolin-2-yl)ethenyl]-3-nitro-benzoic acid Openeye Name: 4-[(E)-2-(5-acetyl-8-hydroxy-2-quinolyl)vinyl]-3-nitro-benzoic acid CAS Name: 4-[(E)-2-(5-acetyl-8-hydroxy-2-quinolinyl)ethenyl]-3-nitrobenzoic acid IUPAC Name: 4-[(E)-2-(5-acetyl-8-hydroxyquinolin-2-yl)ethenyl]-3-nitrobenzoic acid Traditional Name: 4-[(E)-2-(5-acetyl-8-hydroxy-2-quinolyl)vinyl]-3-nitro-benzoic acid Formula: C20H14N2O6 MolecularWeight: 378.33496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C2C=CC(=NC2=C(C=C1)O)C=CC3=C(C=C(C=C3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=C2C=CC(=NC2=C(C=C1)O)/C=C/C3=C(C=C(C=C3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C20H14N2O6/c1-11(23)15-8-9-18(24)19-16(15)7-6-14(21-19)5-4-12-2-3-13(20(25)26)10-17(12)22(27)28/h2-10,24H,1H3,(H,25,26)/b5-4+