5-chloranyl-2-(5-ethyl-5-methyl-2-pyrimidin-5-yl-1,3-dioxan-2-yl)benzenecarbonitrile

Systemtic Name: 5-chloranyl-2-(5-ethyl-5-methyl-2-pyrimidin-5-yl-1,3-dioxan-2-yl)benzenecarbonitrile Openeye Name: 5-chloro-2-(5-ethyl-5-methyl-2-pyrimidin-5-yl-1,3-dioxan-2-yl)benzonitrile CAS Name: 5-chloro-2-[5-ethyl-5-methyl-2-(5-pyrimidinyl)-1,3-dioxan-2-yl]benzonitrile IUPAC Name: 5-chloro-2-(5-ethyl-5-methyl-2-pyrimidin-5-yl-1,3-dioxan-2-yl)benzonitrile Traditional Name: 5-chloro-2-[5-ethyl-5-methyl-2-(5-pyrimidyl)-1,3-dioxan-2-yl]benzonitrile Formula: C18H18ClN3O2 MolecularWeight: 343.80742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(COC(OC1)(C2=C(C=C(C=C2)Cl)C#N)C3=CN=CN=C3)C

Isomeric SMILES

CCC1(COC(OC1)(C2=C(C=C(C=C2)Cl)C#N)C3=CN=CN=C3)C

InChI

InChI=1S/C18H18ClN3O2/c1-3-17(2)10-23-18(24-11-17,14-8-21-12-22-9-14)16-5-4-15(19)6-13(16)7-20/h4-6,8-9,12H,3,10-11H2,1-2H3