2-(4-chlorophenyl)-3-methyl-N-octyl-quinoline-4-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-3-methyl-N-octyl-quinoline-4-carboxamide Openeye Name: 2-(4-chlorophenyl)-3-methyl-N-octyl-quinoline-4-carboxamide CAS Name: 2-(4-chlorophenyl)-3-methyl-N-octyl-4-quinolinecarboxamide IUPAC Name: 2-(4-chlorophenyl)-3-methyl-N-octylquinoline-4-carboxamide Traditional Name: 2-(4-chlorophenyl)-3-methyl-N-octyl-cinchoninamide Formula: C25H29ClN2O MolecularWeight: 408.96356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCCCCCCCNC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C25H29ClN2O/c1-3-4-5-6-7-10-17-27-25(29)23-18(2)24(19-13-15-20(26)16-14-19)28-22-12-9-8-11-21(22)23/h8-9,11-16H,3-7,10,17H2,1-2H3,(H,27,29)