6-[4-(1,3-benzodioxol-5-yl)-6-phenyl-pyridin-2-yl]oxy-2,2-dimethyl-hexanenitrile

Systemtic Name: 6-[4-(1,3-benzodioxol-5-yl)-6-phenyl-pyridin-2-yl]oxy-2,2-dimethyl-hexanenitrile Openeye Name: 6-[[4-(1,3-benzodioxol-5-yl)-6-phenyl-2-pyridyl]oxy]-2,2-dimethyl-hexanenitrile CAS Name: 6-[[4-(1,3-benzodioxol-5-yl)-6-phenyl-2-pyridinyl]oxy]-2,2-dimethylhexanenitrile IUPAC Name: 6-[4-(1,3-benzodioxol-5-yl)-6-phenylpyridin-2-yl]oxy-2,2-dimethylhexanenitrile Traditional Name: 6-[[4-(1,3-benzodioxol-5-yl)-6-phenyl-2-pyridyl]oxy]-2,2-dimethyl-hexanenitrile Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCOC1=CC(=CC(=N1)C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4)C#N

Isomeric SMILES

CC(C)(CCCCOC1=CC(=CC(=N1)C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4)C#N

InChI

InChI=1S/C26H26N2O3/c1-26(2,17-27)12-6-7-13-29-25-16-21(14-22(28-25)19-8-4-3-5-9-19)20-10-11-23-24(15-20)31-18-30-23/h3-5,8-11,14-16H,6-7,12-13,18H2,1-2H3