2-(2,4-dimethoxyphenyl)-6-fluoranyl-N-[1-(phenylmethyl)piperidin-4-yl]quinoline-4-carboxamide

Systemtic Name: 2-(2,4-dimethoxyphenyl)-6-fluoranyl-N-[1-(phenylmethyl)piperidin-4-yl]quinoline-4-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-2-(2,4-dimethoxyphenyl)-6-fluoro-quinoline-4-carboxamide CAS Name: 2-(2,4-dimethoxyphenyl)-6-fluoro-N-[1-(phenylmethyl)-4-piperidinyl]-4-quinolinecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-(2,4-dimethoxyphenyl)-6-fluoroquinoline-4-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-2-(2,4-dimethoxyphenyl)-6-fluoro-cinchoninamide Formula: C30H30FN3O3 MolecularWeight: 499.575903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)NC4CCN(CC4)CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)NC4CCN(CC4)CC5=CC=CC=C5)OC

InChI

InChI=1S/C30H30FN3O3/c1-36-23-9-10-24(29(17-23)37-2)28-18-26(25-16-21(31)8-11-27(25)33-28)30(35)32-22-12-14-34(15-13-22)19-20-6-4-3-5-7-20/h3-11,16-18,22H,12-15,19H2,1-2H3,(H,32,35)