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

Systemtic Name: 2-[3-[[1-(1H-indol-3-yl)-2-methyl-propan-2-yl]amino]-2-oxidanyl-propoxy]-5-oxidanyl-benzenecarbonitrile Openeye Name: 5-hydroxy-2-[2-hydroxy-3-[[2-(1H-indol-3-yl)-1,1-dimethyl-ethyl]amino]propoxy]benzonitrile CAS Name: 5-hydroxy-2-[2-hydroxy-3-[[1-(1H-indol-3-yl)-2-methylpropan-2-yl]amino]propoxy]benzonitrile IUPAC Name: 5-hydroxy-2-[2-hydroxy-3-[[1-(1H-indol-3-yl)-2-methylpropan-2-yl]amino]propoxy]benzonitrile Traditional Name: 5-hydroxy-2-[2-hydroxy-3-[[2-(1H-indol-3-yl)-1,1-dimethyl-ethyl]amino]propoxy]benzonitrile Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CNC2=CC=CC=C21)NCC(COC3=C(C=C(C=C3)O)C#N)O

Isomeric SMILES

CC(C)(CC1=CNC2=CC=CC=C21)NCC(COC3=C(C=C(C=C3)O)C#N)O

InChI

InChI=1S/C22H25N3O3/c1-22(2,10-16-12-24-20-6-4-3-5-19(16)20)25-13-18(27)14-28-21-8-7-17(26)9-15(21)11-23/h3-9,12,18,24-27H,10,13-14H2,1-2H3