[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: [2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: [2-[(2-chlorophenyl)methylamino]-2-oxo-ethyl] 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid [2-[(2-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C23H17ClN2O3S MolecularWeight: 436.91068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4)Cl

InChI

InChI=1S/C23H17ClN2O3S/c24-18-8-3-1-6-15(18)13-25-22(27)14-29-23(28)17-12-20(21-10-5-11-30-21)26-19-9-4-2-7-16(17)19/h1-12H,13-14H2,(H,25,27)