2-bromanyl-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-5-[2-(2-methoxyphenyl)ethynyl]benzamide

Systemtic Name: 2-bromanyl-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-5-[2-(2-methoxyphenyl)ethynyl]benzamide Openeye Name: 2-bromo-N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-5-[2-(2-methoxyphenyl)ethynyl]benzamide CAS Name: 2-bromo-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-5-[2-(2-methoxyphenyl)ethynyl]benzamide IUPAC Name: 2-bromo-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-5-[2-(2-methoxyphenyl)ethynyl]benzamide Traditional Name: 2-bromo-N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]-5-[2-(2-methoxyphenyl)ethynyl]benzamide Formula: C27H23BrN2O3 MolecularWeight: 503.38712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C#CC2=CC(=C(C=C2)Br)C(=O)NC(CC3=CNC4=CC=CC=C43)CO

Isomeric SMILES

COC1=CC=CC=C1C#CC2=CC(=C(C=C2)Br)C(=O)N[C@H](CC3=CNC4=CC=CC=C43)CO

InChI

InChI=1S/C27H23BrN2O3/c1-33-26-9-5-2-6-19(26)12-10-18-11-13-24(28)23(14-18)27(32)30-21(17-31)15-20-16-29-25-8-4-3-7-22(20)25/h2-9,11,13-14,16,21,29,31H,15,17H2,1H3,(H,30,32)/t21-/m1/s1