2-[(E)-2-(7-methoxy-1-benzofuran-2-yl)ethenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[(E)-2-(7-methoxy-1-benzofuran-2-yl)ethenyl]quinoline-4-carboxylic acid Openeye Name: 2-[(E)-2-(7-methoxybenzofuran-2-yl)vinyl]quinoline-4-carboxylic acid CAS Name: 2-[(E)-2-(7-methoxy-2-benzofuranyl)ethenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[(E)-2-(7-methoxy-1-benzofuran-2-yl)ethenyl]quinoline-4-carboxylic acid Traditional Name: 2-[(E)-2-(7-methoxybenzofuran-2-yl)vinyl]cinchoninic acid Formula: C21H15NO4 MolecularWeight: 345.3481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=C2)C=CC3=NC4=CC=CC=C4C(=C3)C(=O)O

Isomeric SMILES

COC1=CC=CC2=C1OC(=C2)/C=C/C3=NC4=CC=CC=C4C(=C3)C(=O)O

InChI

InChI=1S/C21H15NO4/c1-25-19-8-4-5-13-11-15(26-20(13)19)10-9-14-12-17(21(23)24)16-6-2-3-7-18(16)22-14/h2-12H,1H3,(H,23,24)/b10-9+