quinolin-8-yl 6,8-dimethyl-2-thiophen-2-yl-quinoline-4-carboxylate

Systemtic Name: quinolin-8-yl 6,8-dimethyl-2-thiophen-2-yl-quinoline-4-carboxylate Openeye Name: 8-quinolyl 6,8-dimethyl-2-(2-thienyl)quinoline-4-carboxylate CAS Name: 6,8-dimethyl-2-thiophen-2-yl-4-quinolinecarboxylic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl 6,8-dimethyl-2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 6,8-dimethyl-2-(2-thienyl)cinchoninic acid 8-quinolyl ester Formula: C25H18N2O2S MolecularWeight: 410.48762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OC4=CC=CC5=C4N=CC=C5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OC4=CC=CC5=C4N=CC=C5)C

InChI

InChI=1S/C25H18N2O2S/c1-15-12-16(2)23-18(13-15)19(14-20(27-23)22-9-5-11-30-22)25(28)29-21-8-3-6-17-7-4-10-26-24(17)21/h3-14H,1-2H3