2-(2,3-dihydro-1-benzofuran-5-yl)-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]quinoline-4-carboxamide

Systemtic Name: 2-(2,3-dihydro-1-benzofuran-5-yl)-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]quinoline-4-carboxamide Openeye Name: 2-(2,3-dihydrobenzofuran-5-yl)-N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]quinoline-4-carboxamide CAS Name: 2-(2,3-dihydrobenzofuran-5-yl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-4-quinolinecarboxamide IUPAC Name: 2-(2,3-dihydro-1-benzofuran-5-yl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]quinoline-4-carboxamide Traditional Name: 2-coumaran-5-yl-N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]cinchoninamide Formula: C29H25N3O3 MolecularWeight: 463.5271

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC(CC5=CNC6=CC=CC=C65)CO

Isomeric SMILES

C1COC2=C1C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)N[C@H](CC5=CNC6=CC=CC=C65)CO

InChI

InChI=1S/C29H25N3O3/c33-17-21(14-20-16-30-25-7-3-1-5-22(20)25)31-29(34)24-15-27(32-26-8-4-2-6-23(24)26)18-9-10-28-19(13-18)11-12-35-28/h1-10,13,15-16,21,30,33H,11-12,14,17H2,(H,31,34)/t21-/m1/s1