2-fluoranyl-4-[[4-(4-heptylcyclohexyl)phenyl]methoxy]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-4-[[4-(4-heptylcyclohexyl)phenyl]methoxy]benzenecarbonitrile Openeye Name: 2-fluoro-4-[[4-(4-heptylcyclohexyl)phenyl]methoxy]benzonitrile CAS Name: 2-fluoro-4-[[4-(4-heptylcyclohexyl)phenyl]methoxy]benzonitrile IUPAC Name: 2-fluoro-4-[[4-(4-heptylcyclohexyl)phenyl]methoxy]benzonitrile Traditional Name: 2-fluoro-4-[4-(4-heptylcyclohexyl)benzyl]oxy-benzonitrile Formula: C27H34FNO MolecularWeight: 407.563363

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)COC3=CC(=C(C=C3)C#N)F

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)COC3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C27H34FNO/c1-2-3-4-5-6-7-21-8-12-23(13-9-21)24-14-10-22(11-15-24)20-30-26-17-16-25(19-29)27(28)18-26/h10-11,14-18,21,23H,2-9,12-13,20H2,1H3