2,3-bis(fluoranyl)-4-[[4-(4-heptylphenyl)cyclohexyl]methoxy]benzenecarbonitrile

Systemtic Name: 2,3-bis(fluoranyl)-4-[[4-(4-heptylphenyl)cyclohexyl]methoxy]benzenecarbonitrile Openeye Name: 2,3-difluoro-4-[[4-(4-heptylphenyl)cyclohexyl]methoxy]benzonitrile CAS Name: 2,3-difluoro-4-[[4-(4-heptylphenyl)cyclohexyl]methoxy]benzonitrile IUPAC Name: 2,3-difluoro-4-[[4-(4-heptylphenyl)cyclohexyl]methoxy]benzonitrile Traditional Name: 2,3-difluoro-4-[[4-(4-heptylphenyl)cyclohexyl]methoxy]benzonitrile Formula: C27H33F2NO MolecularWeight: 425.553826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2CCC(CC2)COC3=C(C(=C(C=C3)C#N)F)F

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2CCC(CC2)COC3=C(C(=C(C=C3)C#N)F)F

InChI

InChI=1S/C27H33F2NO/c1-2-3-4-5-6-7-20-8-12-22(13-9-20)23-14-10-21(11-15-23)19-31-25-17-16-24(18-30)26(28)27(25)29/h8-9,12-13,16-17,21,23H,2-7,10-11,14-15,19H2,1H3