4-[4-(6-chloranyl-4-methyl-hexoxy)phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-(6-chloranyl-4-methyl-hexoxy)phenyl]benzenecarbonitrile Openeye Name: 4-[4-(6-chloro-4-methyl-hexoxy)phenyl]benzonitrile CAS Name: 4-[4-(6-chloro-4-methylhexoxy)phenyl]benzonitrile IUPAC Name: 4-[4-(6-chloro-4-methylhexoxy)phenyl]benzonitrile Traditional Name: 4-[4-(6-chloro-4-methyl-hexoxy)phenyl]benzonitrile Formula: C20H22ClNO MolecularWeight: 327.84778

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N)CCCl

Isomeric SMILES

CC(CCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N)CCCl

InChI

InChI=1S/C20H22ClNO/c1-16(12-13-21)3-2-14-23-20-10-8-19(9-11-20)18-6-4-17(15-22)5-7-18/h4-11,16H,2-3,12-14H2,1H3