N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-6-methoxy-2-(7-methoxy-1-benzofuran-2-yl)quinoline-4-carboxamide

Systemtic Name: N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-6-methoxy-2-(7-methoxy-1-benzofuran-2-yl)quinoline-4-carboxamide Openeye Name: N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-6-methoxy-2-(7-methoxybenzofuran-2-yl)quinoline-4-carboxamide CAS Name: N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-6-methoxy-2-(7-methoxy-2-benzofuranyl)-4-quinolinecarboxamide IUPAC Name: N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-6-methoxy-2-(7-methoxy-1-benzofuran-2-yl)quinoline-4-carboxamide Traditional Name: N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]-6-methoxy-2-(7-methoxybenzofuran-2-yl)cinchoninamide Formula: C31H27N3O5 MolecularWeight: 521.56318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C=C2C(=O)NC(CC3=CNC4=CC=CC=C43)CO)C5=CC6=C(O5)C(=CC=C6)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C=C2C(=O)N[C@H](CC3=CNC4=CC=CC=C43)CO)C5=CC6=C(O5)C(=CC=C6)OC

InChI

InChI=1S/C31H27N3O5/c1-37-21-10-11-26-23(14-21)24(15-27(34-26)29-13-18-6-5-9-28(38-2)30(18)39-29)31(36)33-20(17-35)12-19-16-32-25-8-4-3-7-22(19)25/h3-11,13-16,20,32,35H,12,17H2,1-2H3,(H,33,36)/t20-/m1/s1