N-[[4-(dimethylcarbamoyl)phenyl]methyl]-2-(4-methylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[[4-(dimethylcarbamoyl)phenyl]methyl]-2-(4-methylphenyl)quinoline-4-carboxamide Openeye Name: N-[[4-(dimethylcarbamoyl)phenyl]methyl]-2-(p-tolyl)quinoline-4-carboxamide CAS Name: N-[[4-[dimethylamino(oxo)methyl]phenyl]methyl]-2-(4-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[[4-(dimethylcarbamoyl)phenyl]methyl]-2-(4-methylphenyl)quinoline-4-carboxamide Traditional Name: N-[4-(dimethylcarbamoyl)benzyl]-2-(p-tolyl)cinchoninamide Formula: C27H25N3O2 MolecularWeight: 423.5063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=C(C=C4)C(=O)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=C(C=C4)C(=O)N(C)C

InChI

InChI=1S/C27H25N3O2/c1-18-8-12-20(13-9-18)25-16-23(22-6-4-5-7-24(22)29-25)26(31)28-17-19-10-14-21(15-11-19)27(32)30(2)3/h4-16H,17H2,1-3H3,(H,28,31)