4-[4-(5-butylpyrimidin-2-yl)phenoxy]-2-methyl-butanenitrile

Systemtic Name: 4-[4-(5-butylpyrimidin-2-yl)phenoxy]-2-methyl-butanenitrile Openeye Name: 4-[4-(5-butylpyrimidin-2-yl)phenoxy]-2-methyl-butanenitrile CAS Name: 4-[4-(5-butyl-2-pyrimidinyl)phenoxy]-2-methylbutanenitrile IUPAC Name: 4-[4-(5-butylpyrimidin-2-yl)phenoxy]-2-methylbutanenitrile Traditional Name: 4-[4-(5-butylpyrimidin-2-yl)phenoxy]-2-methyl-butyronitrile Formula: C19H23N3O MolecularWeight: 309.40542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C)C#N

Isomeric SMILES

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C)C#N

InChI

InChI=1S/C19H23N3O/c1-3-4-5-16-13-21-19(22-14-16)17-6-8-18(9-7-17)23-11-10-15(2)12-20/h6-9,13-15H,3-5,10-11H2,1-2H3