6,8-bis(chloranyl)-2-(5-ethylthiophen-2-yl)quinoline-4-carboxylic acid

Systemtic Name: 6,8-bis(chloranyl)-2-(5-ethylthiophen-2-yl)quinoline-4-carboxylic acid Openeye Name: 6,8-dichloro-2-(5-ethyl-2-thienyl)quinoline-4-carboxylic acid CAS Name: 6,8-dichloro-2-(5-ethyl-2-thiophenyl)-4-quinolinecarboxylic acid IUPAC Name: 6,8-dichloro-2-(5-ethylthiophen-2-yl)quinoline-4-carboxylic acid Traditional Name: 6,8-dichloro-2-(5-ethyl-2-thienyl)cinchoninic acid Formula: C16H11Cl2NO2S MolecularWeight: 352.23504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)O)Cl)Cl

Isomeric SMILES

CCC1=CC=C(S1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)O)Cl)Cl

InChI

InChI=1S/C16H11Cl2NO2S/c1-2-9-3-4-14(22-9)13-7-11(16(20)21)10-5-8(17)6-12(18)15(10)19-13/h3-7H,2H2,1H3,(H,20,21)