2-(4-chlorophenyl)-2-(2H-pyrimidin-1-ylmethyl)hexanenitrile

Systemtic Name: 2-(4-chlorophenyl)-2-(2H-pyrimidin-1-ylmethyl)hexanenitrile Openeye Name: 2-(4-chlorophenyl)-2-(2H-pyrimidin-1-ylmethyl)hexanenitrile CAS Name: 2-(4-chlorophenyl)-2-(2H-pyrimidin-1-ylmethyl)hexanenitrile IUPAC Name: 2-(4-chlorophenyl)-2-(2H-pyrimidin-1-ylmethyl)hexanenitrile Traditional Name: 2-(4-chlorophenyl)-2-(2H-pyrimidin-1-ylmethyl)hexanenitrile Formula: C17H20ClN3 MolecularWeight: 301.8138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CN1CN=CC=C1)(C#N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCC(CN1CN=CC=C1)(C#N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H20ClN3/c1-2-3-9-17(12-19,13-21-11-4-10-20-14-21)15-5-7-16(18)8-6-15/h4-8,10-11H,2-3,9,13-14H2,1H3