N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-6-methoxy-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-6-methoxy-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-6-methoxy-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-6-methoxy-2-(3,4,5-trimethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-6-methoxy-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]-6-methoxy-2-(3,4,5-trimethoxyphenyl)cinchoninamide Formula: C31H31N3O6 MolecularWeight: 541.59434

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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=CC(=C(C(=C5)OC)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C31H31N3O6/c1-37-21-9-10-26-23(14-21)24(15-27(34-26)18-12-28(38-2)30(40-4)29(13-18)39-3)31(36)33-20(17-35)11-19-16-32-25-8-6-5-7-22(19)25/h5-10,12-16,20,32,35H,11,17H2,1-4H3,(H,33,36)/t20-/m1/s1