[(S)-cyano(quinolin-3-yl)methyl] benzoate

Systemtic Name: [(S)-cyano(quinolin-3-yl)methyl] benzoate Openeye Name: [(S)-cyano(3-quinolyl)methyl] benzoate CAS Name: benzoic acid [(S)-cyano(3-quinolinyl)methyl] ester IUPAC Name: [(S)-cyano(quinolin-3-yl)methyl] benzoate Traditional Name: benzoic acid [(S)-cyano(3-quinolyl)methyl] ester Formula: C18H12N2O2 MolecularWeight: 288.30008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC(C#N)C2=CC3=CC=CC=C3N=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)O[C@H](C#N)C2=CC3=CC=CC=C3N=C2

InChI

InChI=1S/C18H12N2O2/c19-11-17(22-18(21)13-6-2-1-3-7-13)15-10-14-8-4-5-9-16(14)20-12-15/h1-10,12,17H/t17-/m1/s1