(4-acetamidophenyl) 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: (4-acetamidophenyl) 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: (4-acetamidophenyl) 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid (4-acetamidophenyl) ester Formula: C22H16N2O3S MolecularWeight: 388.43904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C22H16N2O3S/c1-14(25)23-15-8-10-16(11-9-15)27-22(26)18-13-20(21-7-4-12-28-21)24-19-6-3-2-5-17(18)19/h2-13H,1H3,(H,23,25)