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

Systemtic Name: 6-[4-(1,3-benzodioxol-5-yl)-6-phenyl-pyridin-2-yl]oxyhexanenitrile Openeye Name: 6-[[4-(1,3-benzodioxol-5-yl)-6-phenyl-2-pyridyl]oxy]hexanenitrile CAS Name: 6-[[4-(1,3-benzodioxol-5-yl)-6-phenyl-2-pyridinyl]oxy]hexanenitrile IUPAC Name: 6-[4-(1,3-benzodioxol-5-yl)-6-phenylpyridin-2-yl]oxyhexanenitrile Traditional Name: 6-[[4-(1,3-benzodioxol-5-yl)-6-phenyl-2-pyridyl]oxy]hexanenitrile Formula: C24H22N2O3 MolecularWeight: 386.44308

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC(=NC(=C3)OCCCCCC#N)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC(=NC(=C3)OCCCCCC#N)C4=CC=CC=C4

InChI

InChI=1S/C24H22N2O3/c25-12-6-1-2-7-13-27-24-16-20(14-21(26-24)18-8-4-3-5-9-18)19-10-11-22-23(15-19)29-17-28-22/h3-5,8-11,14-16H,1-2,6-7,13,17H2