N-(3-chlorophenyl)-2-[4-(2-methylpropyl)phenyl]quinoline-4-carboxamide

Systemtic Name: N-(3-chlorophenyl)-2-[4-(2-methylpropyl)phenyl]quinoline-4-carboxamide Openeye Name: N-(3-chlorophenyl)-2-(4-isobutylphenyl)quinoline-4-carboxamide CAS Name: N-(3-chlorophenyl)-2-[4-(2-methylpropyl)phenyl]-4-quinolinecarboxamide IUPAC Name: N-(3-chlorophenyl)-2-[4-(2-methylpropyl)phenyl]quinoline-4-carboxamide Traditional Name: N-(3-chlorophenyl)-2-(4-isobutylphenyl)cinchoninamide Formula: C26H23ClN2O MolecularWeight: 414.92662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H23ClN2O/c1-17(2)14-18-10-12-19(13-11-18)25-16-23(22-8-3-4-9-24(22)29-25)26(30)28-21-7-5-6-20(27)15-21/h3-13,15-17H,14H2,1-2H3,(H,28,30)