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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[4-(2-methylpropyl)phenyl]quinoline-4-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-(4-isobutylphenyl)quinoline-4-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[4-(2-methylpropyl)phenyl]-4-quinolinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[4-(2-methylpropyl)phenyl]quinoline-4-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-(4-isobutylphenyl)cinchoninamide Formula: C27H25ClN2O MolecularWeight: 428.9532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)CC(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)CC(C)C)Cl

InChI

InChI=1S/C27H25ClN2O/c1-17(2)14-19-9-11-20(12-10-19)26-16-23(22-6-4-5-7-25(22)30-26)27(31)29-21-13-8-18(3)24(28)15-21/h4-13,15-17H,14H2,1-3H3,(H,29,31)