cyanomethyl 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: cyanomethyl 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: cyanomethyl 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid cyanomethyl ester Formula: C16H10N2O2S MolecularWeight: 294.3278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCC#N

InChI

InChI=1S/C16H10N2O2S/c17-7-8-20-16(19)12-10-14(15-6-3-9-21-15)18-13-5-2-1-4-11(12)13/h1-6,9-10H,8H2