N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3,4-dimethylphenyl)-6-fluoranyl-quinoline-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3,4-dimethylphenyl)-6-fluoranyl-quinoline-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3,4-dimethylphenyl)-6-fluoro-quinoline-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3,4-dimethylphenyl)-6-fluoro-4-quinolinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3,4-dimethylphenyl)-6-fluoroquinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-6-fluoro-N-homoveratryl-cinchoninamide Formula: C28H27FN2O3 MolecularWeight: 458.523983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)NCCC4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)NCCC4=CC(=C(C=C4)OC)OC)C

InChI

InChI=1S/C28H27FN2O3/c1-17-5-7-20(13-18(17)2)25-16-23(22-15-21(29)8-9-24(22)31-25)28(32)30-12-11-19-6-10-26(33-3)27(14-19)34-4/h5-10,13-16H,11-12H2,1-4H3,(H,30,32)