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

Systemtic Name: 2-(3-chlorophenyl)-3-methyl-N-phenethyl-quinoline-4-carboxamide Openeye Name: 2-(3-chlorophenyl)-3-methyl-N-phenethyl-quinoline-4-carboxamide CAS Name: 2-(3-chlorophenyl)-3-methyl-N-phenethyl-4-quinolinecarboxamide IUPAC Name: 2-(3-chlorophenyl)-3-methyl-N-phenethylquinoline-4-carboxamide Traditional Name: 2-(3-chlorophenyl)-3-methyl-N-phenethyl-cinchoninamide Formula: C25H21ClN2O MolecularWeight: 400.90004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H21ClN2O/c1-17-23(25(29)27-15-14-18-8-3-2-4-9-18)21-12-5-6-13-22(21)28-24(17)19-10-7-11-20(26)16-19/h2-13,16H,14-15H2,1H3,(H,27,29)