3-[6-chloranyl-2-(piperidin-1-ylmethyl)pyrimidin-4-yl]oxy-4-phenylmethoxy-benzenecarbonitrile

Systemtic Name: 3-[6-chloranyl-2-(piperidin-1-ylmethyl)pyrimidin-4-yl]oxy-4-phenylmethoxy-benzenecarbonitrile Openeye Name: 4-benzyloxy-3-[6-chloro-2-(1-piperidylmethyl)pyrimidin-4-yl]oxy-benzonitrile CAS Name: 3-[[6-chloro-2-(1-piperidinylmethyl)-4-pyrimidinyl]oxy]-4-phenylmethoxybenzonitrile IUPAC Name: 3-[6-chloro-2-(piperidin-1-ylmethyl)pyrimidin-4-yl]oxy-4-phenylmethoxybenzonitrile Traditional Name: 4-benzoxy-3-[6-chloro-2-(piperidinomethyl)pyrimidin-4-yl]oxy-benzonitrile Formula: C24H23ClN4O2 MolecularWeight: 434.91802

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=NC(=CC(=N2)Cl)OC3=C(C=CC(=C3)C#N)OCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CC2=NC(=CC(=N2)Cl)OC3=C(C=CC(=C3)C#N)OCC4=CC=CC=C4

InChI

InChI=1S/C24H23ClN4O2/c25-22-14-24(28-23(27-22)16-29-11-5-2-6-12-29)31-21-13-19(15-26)9-10-20(21)30-17-18-7-3-1-4-8-18/h1,3-4,7-10,13-14H,2,5-6,11-12,16-17H2