2-(3,4-dimethylphenyl)-N-(3,3-diphenylpropyl)-6-fluoranyl-quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-N-(3,3-diphenylpropyl)-6-fluoranyl-quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-(3,3-diphenylpropyl)-6-fluoro-quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-(3,3-diphenylpropyl)-6-fluoro-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-(3,3-diphenylpropyl)-6-fluoroquinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-N-(3,3-diphenylpropyl)-6-fluoro-cinchoninamide Formula: C33H29FN2O MolecularWeight: 488.594563

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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)NCCC(C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)NCCC(C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C33H29FN2O/c1-22-13-14-26(19-23(22)2)32-21-30(29-20-27(34)15-16-31(29)36-32)33(37)35-18-17-28(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,19-21,28H,17-18H2,1-2H3,(H,35,37)