(2-cyanophenyl)methyl 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: (2-cyanophenyl)methyl 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: (2-cyanophenyl)methyl 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid (2-cyanobenzyl) ester Formula: C22H14N2O2S MolecularWeight: 370.42376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4)C#N

InChI

InChI=1S/C22H14N2O2S/c23-13-15-6-1-2-7-16(15)14-26-22(25)18-12-20(21-10-5-11-27-21)24-19-9-4-3-8-17(18)19/h1-12H,14H2