2-(4-chlorophenyl)-N-dodecyl-quinoline-4-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-N-dodecyl-quinoline-4-carboxamide Openeye Name: 2-(4-chlorophenyl)-N-dodecyl-quinoline-4-carboxamide CAS Name: 2-(4-chlorophenyl)-N-dodecyl-4-quinolinecarboxamide IUPAC Name: 2-(4-chlorophenyl)-N-dodecylquinoline-4-carboxamide Traditional Name: 2-(4-chlorophenyl)-N-lauryl-cinchoninamide Formula: C28H35ClN2O MolecularWeight: 451.0433

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H35ClN2O/c1-2-3-4-5-6-7-8-9-10-13-20-30-28(32)25-21-27(22-16-18-23(29)19-17-22)31-26-15-12-11-14-24(25)26/h11-12,14-19,21H,2-10,13,20H2,1H3,(H,30,32)