4-[4-(4-chloranylpentan-2-yloxy)phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-(4-chloranylpentan-2-yloxy)phenyl]benzenecarbonitrile Openeye Name: 4-[4-(3-chloro-1-methyl-butoxy)phenyl]benzonitrile CAS Name: 4-[4-(4-chloropentan-2-yloxy)phenyl]benzonitrile IUPAC Name: 4-[4-(4-chloropentan-2-yloxy)phenyl]benzonitrile Traditional Name: 4-[4-(3-chloro-1-methyl-butoxy)phenyl]benzonitrile Formula: C18H18ClNO MolecularWeight: 299.79462

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)Cl)OC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC(CC(C)Cl)OC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H18ClNO/c1-13(19)11-14(2)21-18-9-7-17(8-10-18)16-5-3-15(12-20)4-6-16/h3-10,13-14H,11H2,1-2H3