2-[2-[3-[2-(4-carboxyquinolin-2-yl)ethenyl]phenyl]ethenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[2-[3-[2-(4-carboxyquinolin-2-yl)ethenyl]phenyl]ethenyl]quinoline-4-carboxylic acid Openeye Name: 2-[2-[3-[2-(4-carboxy-2-quinolyl)vinyl]phenyl]vinyl]quinoline-4-carboxylic acid CAS Name: 2-[2-[3-[2-(4-carboxy-2-quinolinyl)ethenyl]phenyl]ethenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[2-[3-[2-(4-carboxyquinolin-2-yl)ethenyl]phenyl]ethenyl]quinoline-4-carboxylic acid Traditional Name: 2-[2-[3-[2-(4-carboxy-2-quinolyl)vinyl]phenyl]vinyl]cinchoninic acid Formula: C30H20N2O4 MolecularWeight: 472.4908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C=CC3=CC(=CC=C3)C=CC4=NC5=CC=CC=C5C(=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C=CC3=CC(=CC=C3)C=CC4=NC5=CC=CC=C5C(=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C30H20N2O4/c33-29(34)25-17-21(31-27-10-3-1-8-23(25)27)14-12-19-6-5-7-20(16-19)13-15-22-18-26(30(35)36)24-9-2-4-11-28(24)32-22/h1-18H,(H,33,34)(H,35,36)