N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-5-(4-oxidanylbut-1-ynyl)-2-propan-2-yloxy-benzamide

Systemtic Name: N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-5-(4-oxidanylbut-1-ynyl)-2-propan-2-yloxy-benzamide Openeye Name: 5-(4-hydroxybut-1-ynyl)-N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-2-isopropoxy-benzamide CAS Name: 5-(4-hydroxybut-1-ynyl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-2-propan-2-yloxybenzamide IUPAC Name: 5-(4-hydroxybut-1-ynyl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-2-propan-2-yloxybenzamide Traditional Name: 5-(4-hydroxybut-1-ynyl)-N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]-2-isopropoxy-benzamide Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C#CCCO)C(=O)NC(CC2=CNC3=CC=CC=C32)CO

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C#CCCO)C(=O)N[C@H](CC2=CNC3=CC=CC=C32)CO

InChI

InChI=1S/C25H28N2O4/c1-17(2)31-24-11-10-18(7-5-6-12-28)13-22(24)25(30)27-20(16-29)14-19-15-26-23-9-4-3-8-21(19)23/h3-4,8-11,13,15,17,20,26,28-29H,6,12,14,16H2,1-2H3,(H,27,30)/t20-/m1/s1