2-[1-(6,7-dimethoxyphthalazin-1-yl)piperidin-4-yl]oxybenzenecarbonitrile

Systemtic Name: 2-[1-(6,7-dimethoxyphthalazin-1-yl)piperidin-4-yl]oxybenzenecarbonitrile Openeye Name: 2-[[1-(6,7-dimethoxyphthalazin-1-yl)-4-piperidyl]oxy]benzonitrile CAS Name: 2-[[1-(6,7-dimethoxy-1-phthalazinyl)-4-piperidinyl]oxy]benzonitrile IUPAC Name: 2-[1-(6,7-dimethoxyphthalazin-1-yl)piperidin-4-yl]oxybenzonitrile Traditional Name: 2-[[1-(6,7-dimethoxyphthalazin-1-yl)-4-piperidyl]oxy]benzonitrile Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=NN=C2N3CCC(CC3)OC4=CC=CC=C4C#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=NN=C2N3CCC(CC3)OC4=CC=CC=C4C#N)OC

InChI

InChI=1S/C22H22N4O3/c1-27-20-11-16-14-24-25-22(18(16)12-21(20)28-2)26-9-7-17(8-10-26)29-19-6-4-3-5-15(19)13-23/h3-6,11-12,14,17H,7-10H2,1-2H3