2-[5-ethanoyl-2-[3-[[1-(1H-indol-3-yl)-2-methyl-propan-2-yl]amino]-2-oxidanyl-propoxy]phenyl]ethanenitrile

Systemtic Name: 2-[5-ethanoyl-2-[3-[[1-(1H-indol-3-yl)-2-methyl-propan-2-yl]amino]-2-oxidanyl-propoxy]phenyl]ethanenitrile Openeye Name: 2-[5-acetyl-2-[2-hydroxy-3-[[2-(1H-indol-3-yl)-1,1-dimethyl-ethyl]amino]propoxy]phenyl]acetonitrile CAS Name: 2-[5-acetyl-2-[2-hydroxy-3-[[1-(1H-indol-3-yl)-2-methylpropan-2-yl]amino]propoxy]phenyl]acetonitrile IUPAC Name: 2-[5-acetyl-2-[2-hydroxy-3-[[1-(1H-indol-3-yl)-2-methylpropan-2-yl]amino]propoxy]phenyl]acetonitrile Traditional Name: 2-[5-acetyl-2-[2-hydroxy-3-[[2-(1H-indol-3-yl)-1,1-dimethyl-ethyl]amino]propoxy]phenyl]acetonitrile Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCC(CNC(C)(C)CC2=CNC3=CC=CC=C32)O)CC#N

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCC(CNC(C)(C)CC2=CNC3=CC=CC=C32)O)CC#N

InChI

InChI=1S/C25H29N3O3/c1-17(29)18-8-9-24(19(12-18)10-11-26)31-16-21(30)15-28-25(2,3)13-20-14-27-23-7-5-4-6-22(20)23/h4-9,12,14,21,27-28,30H,10,13,15-16H2,1-3H3