N,N-bis(cyanomethyl)-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N,N-bis(cyanomethyl)-2-phenyl-quinoline-4-carboxamide Openeye Name: N,N-bis(cyanomethyl)-2-phenyl-quinoline-4-carboxamide CAS Name: N,N-bis(cyanomethyl)-2-phenyl-4-quinolinecarboxamide IUPAC Name: N,N-bis(cyanomethyl)-2-phenylquinoline-4-carboxamide Traditional Name: N,N-bis(cyanomethyl)-2-phenyl-cinchoninamide Formula: C20H14N4O MolecularWeight: 326.35136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14N4O/c21-10-12-24(13-11-22)20(25)17-14-19(15-6-2-1-3-7-15)23-18-9-5-4-8-16(17)18/h1-9,14H,12-13H2