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

Systemtic Name: 5-(5-cyanopent-1-ynyl)-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-2-propan-2-yloxy-benzamide Openeye Name: 5-(5-cyanopent-1-ynyl)-N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-2-isopropoxy-benzamide CAS Name: 5-(5-cyanopent-1-ynyl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-2-propan-2-yloxybenzamide IUPAC Name: 5-(5-cyanopent-1-ynyl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-2-propan-2-yloxybenzamide Traditional Name: 5-(5-cyanopent-1-ynyl)-N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]-2-isopropoxy-benzamide Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O3/c1-19(2)33-26-13-12-20(9-5-3-4-8-14-28)15-24(26)27(32)30-22(18-31)16-21-17-29-25-11-7-6-10-23(21)25/h6-7,10-13,15,17,19,22,29,31H,3-4,8,16,18H2,1-2H3,(H,30,32)/t22-/m1/s1