2-[(2-methylphenyl)amino]-N-(4-phenylbutan-2-yl)quinoline-4-carboxamide

Systemtic Name: 2-[(2-methylphenyl)amino]-N-(4-phenylbutan-2-yl)quinoline-4-carboxamide Openeye Name: 2-(2-methylanilino)-N-(1-methyl-3-phenyl-propyl)quinoline-4-carboxamide CAS Name: 2-(2-methylanilino)-N-(4-phenylbutan-2-yl)-4-quinolinecarboxamide IUPAC Name: 2-(2-methylanilino)-N-(4-phenylbutan-2-yl)quinoline-4-carboxamide Traditional Name: N-(1-methyl-3-phenyl-propyl)-2-(o-toluidino)cinchoninamide Formula: C27H27N3O MolecularWeight: 409.52278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1NC2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)CCC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O/c1-19-10-6-8-14-24(19)29-26-18-23(22-13-7-9-15-25(22)30-26)27(31)28-20(2)16-17-21-11-4-3-5-12-21/h3-15,18,20H,16-17H2,1-2H3,(H,28,31)(H,29,30)