5,7-dimethyl-2-thiophen-2-yl-quinoline-4-carboxylic acid

Systemtic Name: 5,7-dimethyl-2-thiophen-2-yl-quinoline-4-carboxylic acid Openeye Name: 5,7-dimethyl-2-(2-thienyl)quinoline-4-carboxylic acid CAS Name: 5,7-dimethyl-2-thiophen-2-yl-4-quinolinecarboxylic acid IUPAC Name: 5,7-dimethyl-2-thiophen-2-ylquinoline-4-carboxylic acid Traditional Name: 5,7-dimethyl-2-(2-thienyl)cinchoninic acid Formula: C16H13NO2S MolecularWeight: 283.34492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=CC(=NC2=C1)C3=CC=CS3)C(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=CC(=NC2=C1)C3=CC=CS3)C(=O)O)C

InChI

InChI=1S/C16H13NO2S/c1-9-6-10(2)15-11(16(18)19)8-12(17-13(15)7-9)14-4-3-5-20-14/h3-8H,1-2H3,(H,18,19)