2-[(E)-2-(4,5-dimethoxy-2-nitro-phenyl)ethenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[(E)-2-(4,5-dimethoxy-2-nitro-phenyl)ethenyl]quinoline-4-carboxylic acid Openeye Name: 2-[(E)-2-(4,5-dimethoxy-2-nitro-phenyl)vinyl]quinoline-4-carboxylic acid CAS Name: 2-[(E)-2-(4,5-dimethoxy-2-nitrophenyl)ethenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[(E)-2-(4,5-dimethoxy-2-nitrophenyl)ethenyl]quinoline-4-carboxylic acid Traditional Name: 2-[(E)-2-(4,5-dimethoxy-2-nitro-phenyl)vinyl]cinchoninic acid Formula: C20H16N2O6 MolecularWeight: 380.35084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=CC2=NC3=CC=CC=C3C(=C2)C(=O)O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C/C2=NC3=CC=CC=C3C(=C2)C(=O)O)[N+](=O)[O-])OC

InChI

InChI=1S/C20H16N2O6/c1-27-18-9-12(17(22(25)26)11-19(18)28-2)7-8-13-10-15(20(23)24)14-5-3-4-6-16(14)21-13/h3-11H,1-2H3,(H,23,24)/b8-7+