4-chloranyl-2-(4-oxidanyl-1-pyridin-4-yl-butoxy)benzenecarbonitrile

Systemtic Name: 4-chloranyl-2-(4-oxidanyl-1-pyridin-4-yl-butoxy)benzenecarbonitrile Openeye Name: 4-chloro-2-[4-hydroxy-1-(4-pyridyl)butoxy]benzonitrile CAS Name: 4-chloro-2-(4-hydroxy-1-pyridin-4-ylbutoxy)benzonitrile IUPAC Name: 4-chloro-2-(4-hydroxy-1-pyridin-4-ylbutoxy)benzonitrile Traditional Name: 4-chloro-2-[4-hydroxy-1-(4-pyridyl)butoxy]benzonitrile Formula: C16H15ClN2O2 MolecularWeight: 302.7555

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)OC(CCCO)C2=CC=NC=C2)C#N

Isomeric SMILES

C1=CC(=C(C=C1Cl)OC(CCCO)C2=CC=NC=C2)C#N

InChI

InChI=1S/C16H15ClN2O2/c17-14-4-3-13(11-18)16(10-14)21-15(2-1-9-20)12-5-7-19-8-6-12/h3-8,10,15,20H,1-2,9H2