(2-chlorophenyl) 6,8-dimethyl-2-thiophen-2-yl-quinoline-4-carboxylate

Systemtic Name: (2-chlorophenyl) 6,8-dimethyl-2-thiophen-2-yl-quinoline-4-carboxylate Openeye Name: (2-chlorophenyl) 6,8-dimethyl-2-(2-thienyl)quinoline-4-carboxylate CAS Name: 6,8-dimethyl-2-thiophen-2-yl-4-quinolinecarboxylic acid (2-chlorophenyl) ester IUPAC Name: (2-chlorophenyl) 6,8-dimethyl-2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 6,8-dimethyl-2-(2-thienyl)cinchoninic acid (2-chlorophenyl) ester Formula: C22H16ClNO2S MolecularWeight: 393.88594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OC4=CC=CC=C4Cl)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OC4=CC=CC=C4Cl)C

InChI

InChI=1S/C22H16ClNO2S/c1-13-10-14(2)21-15(11-13)16(12-18(24-21)20-8-5-9-27-20)22(25)26-19-7-4-3-6-17(19)23/h3-12H,1-2H3