2-[(E)-2-(4-imidazol-1-ylphenyl)ethenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[(E)-2-(4-imidazol-1-ylphenyl)ethenyl]quinoline-4-carboxylic acid Openeye Name: 2-[(E)-2-(4-imidazol-1-ylphenyl)vinyl]quinoline-4-carboxylic acid CAS Name: 2-[(E)-2-[4-(1-imidazolyl)phenyl]ethenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[(E)-2-(4-imidazol-1-ylphenyl)ethenyl]quinoline-4-carboxylic acid Traditional Name: 2-[(E)-2-(4-imidazol-1-ylphenyl)vinyl]cinchoninic acid Formula: C21H15N3O2 MolecularWeight: 341.3627

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C=CC3=CC=C(C=C3)N4C=CN=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)/C=C/C3=CC=C(C=C3)N4C=CN=C4)C(=O)O

InChI

InChI=1S/C21H15N3O2/c25-21(26)19-13-16(23-20-4-2-1-3-18(19)20)8-5-15-6-9-17(10-7-15)24-12-11-22-14-24/h1-14H,(H,25,26)/b8-5+