cyanomethyl 2-phenylquinoline-4-carboxylate

Systemtic Name: cyanomethyl 2-phenylquinoline-4-carboxylate Openeye Name: cyanomethyl 2-phenylquinoline-4-carboxylate CAS Name: 2-phenyl-4-quinolinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-phenylquinoline-4-carboxylate Traditional Name: 2-phenylcinchoninic acid cyanomethyl ester Formula: C18H12N2O2 MolecularWeight: 288.30008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC#N

InChI

InChI=1S/C18H12N2O2/c19-10-11-22-18(21)15-12-17(13-6-2-1-3-7-13)20-16-9-5-4-8-14(15)16/h1-9,12H,11H2