[(1S)-1-cyanoethyl] quinoline-2-carboxylate

Systemtic Name: [(1S)-1-cyanoethyl] quinoline-2-carboxylate Openeye Name: [(1S)-1-cyanoethyl] quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [(1S)-1-cyanoethyl] ester IUPAC Name: [(1S)-1-cyanoethyl] quinoline-2-carboxylate Traditional Name: quinaldic acid [(1S)-1-cyanoethyl] ester Formula: C13H10N2O2 MolecularWeight: 226.2307

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1=NC2=CC=CC=C2C=C1

Isomeric SMILES

C[C@@H](C#N)OC(=O)C1=NC2=CC=CC=C2C=C1

InChI

InChI=1S/C13H10N2O2/c1-9(8-14)17-13(16)12-7-6-10-4-2-3-5-11(10)15-12/h2-7,9H,1H3/t9-/m0/s1