3-[6-chloranyl-2-(4-methoxyphenyl)pyrimidin-4-yl]oxy-4-phenylmethoxy-benzenecarbonitrile

Systemtic Name: 3-[6-chloranyl-2-(4-methoxyphenyl)pyrimidin-4-yl]oxy-4-phenylmethoxy-benzenecarbonitrile Openeye Name: 4-benzyloxy-3-[6-chloro-2-(4-methoxyphenyl)pyrimidin-4-yl]oxy-benzonitrile CAS Name: 3-[[6-chloro-2-(4-methoxyphenyl)-4-pyrimidinyl]oxy]-4-phenylmethoxybenzonitrile IUPAC Name: 3-[6-chloro-2-(4-methoxyphenyl)pyrimidin-4-yl]oxy-4-phenylmethoxybenzonitrile Traditional Name: 4-benzoxy-3-[6-chloro-2-(4-methoxyphenyl)pyrimidin-4-yl]oxy-benzonitrile Formula: C25H18ClN3O3 MolecularWeight: 443.88172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CC(=N2)Cl)OC3=C(C=CC(=C3)C#N)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CC(=N2)Cl)OC3=C(C=CC(=C3)C#N)OCC4=CC=CC=C4

InChI

InChI=1S/C25H18ClN3O3/c1-30-20-10-8-19(9-11-20)25-28-23(26)14-24(29-25)32-22-13-18(15-27)7-12-21(22)31-16-17-5-3-2-4-6-17/h2-14H,16H2,1H3