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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCCCC(CC)CNC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C25H29ClN2O/c1-4-6-9-18(5-2)16-27-25(29)23-17(3)24(19-12-14-20(26)15-13-19)28-22-11-8-7-10-21(22)23/h7-8,10-15,18H,4-6,9,16H2,1-3H3,(H,27,29)