N-butan-2-yl-2-(4-chlorophenyl)-3-methyl-quinoline-4-carboxamide

Systemtic Name: N-butan-2-yl-2-(4-chlorophenyl)-3-methyl-quinoline-4-carboxamide Openeye Name: 2-(4-chlorophenyl)-3-methyl-N-sec-butyl-quinoline-4-carboxamide CAS Name: N-butan-2-yl-2-(4-chlorophenyl)-3-methyl-4-quinolinecarboxamide IUPAC Name: N-butan-2-yl-2-(4-chlorophenyl)-3-methylquinoline-4-carboxamide Traditional Name: 2-(4-chlorophenyl)-3-methyl-N-sec-butyl-cinchoninamide Formula: C21H21ClN2O MolecularWeight: 352.85724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCC(C)NC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H21ClN2O/c1-4-13(2)23-21(25)19-14(3)20(15-9-11-16(22)12-10-15)24-18-8-6-5-7-17(18)19/h5-13H,4H2,1-3H3,(H,23,25)