2-(3-acetamidophenyl)-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]quinoline-4-carboxamide

Systemtic Name: 2-(3-acetamidophenyl)-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]quinoline-4-carboxamide Openeye Name: 2-(3-acetamidophenyl)-N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]quinoline-4-carboxamide CAS Name: 2-(3-acetamidophenyl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-4-quinolinecarboxamide IUPAC Name: 2-(3-acetamidophenyl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]quinoline-4-carboxamide Traditional Name: 2-(3-acetamidophenyl)-N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]cinchoninamide Formula: C29H26N4O3 MolecularWeight: 478.54174

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(CC4=CNC5=CC=CC=C54)CO

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N[C@H](CC4=CNC5=CC=CC=C54)CO

InChI

InChI=1S/C29H26N4O3/c1-18(35)31-21-8-6-7-19(13-21)28-15-25(24-10-3-5-12-27(24)33-28)29(36)32-22(17-34)14-20-16-30-26-11-4-2-9-23(20)26/h2-13,15-16,22,30,34H,14,17H2,1H3,(H,31,35)(H,32,36)/t22-/m1/s1