2-(4-fluorophenyl)-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]quinoline-4-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]quinoline-4-carboxamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)-4-piperidyl]-2-(4-fluorophenyl)quinoline-4-carboxamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidinyl]-2-(4-fluorophenyl)-4-quinolinecarboxamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(4-fluorophenyl)quinoline-4-carboxamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)-4-piperidyl]-2-(4-fluorophenyl)cinchoninamide Formula: C29H27FN4O2 MolecularWeight: 482.548683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)F)CC(=O)NC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)F)CC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C29H27FN4O2/c30-21-12-10-20(11-13-21)27-18-25(24-8-4-5-9-26(24)33-27)29(36)32-23-14-16-34(17-15-23)19-28(35)31-22-6-2-1-3-7-22/h1-13,18,23H,14-17,19H2,(H,31,35)(H,32,36)