N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-6-[2-(2-methoxyphenyl)ethynyl]quinoline-8-carboxamide

Systemtic Name: N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-6-[2-(2-methoxyphenyl)ethynyl]quinoline-8-carboxamide Openeye Name: N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-6-[2-(2-methoxyphenyl)ethynyl]quinoline-8-carboxamide CAS Name: N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-6-[2-(2-methoxyphenyl)ethynyl]-8-quinolinecarboxamide IUPAC Name: N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-6-[2-(2-methoxyphenyl)ethynyl]quinoline-8-carboxamide Traditional Name: N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]-6-[2-(2-methoxyphenyl)ethynyl]quinoline-8-carboxamide Formula: C30H25N3O3 MolecularWeight: 475.5378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C#CC2=CC3=C(C(=C2)C(=O)NC(CC4=CNC5=CC=CC=C54)CO)N=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C#CC2=CC3=C(C(=C2)C(=O)N[C@H](CC4=CNC5=CC=CC=C54)CO)N=CC=C3

InChI

InChI=1S/C30H25N3O3/c1-36-28-11-5-2-7-21(28)13-12-20-15-22-8-6-14-31-29(22)26(16-20)30(35)33-24(19-34)17-23-18-32-27-10-4-3-9-25(23)27/h2-11,14-16,18,24,32,34H,17,19H2,1H3,(H,33,35)/t24-/m1/s1