1-(2-fluoranyl-4-methoxy-phenyl)-4-heptyl-cyclohexane-1-carbonitrile

Systemtic Name: 1-(2-fluoranyl-4-methoxy-phenyl)-4-heptyl-cyclohexane-1-carbonitrile Openeye Name: 1-(2-fluoro-4-methoxy-phenyl)-4-heptyl-cyclohexanecarbonitrile CAS Name: 1-(2-fluoro-4-methoxyphenyl)-4-heptyl-1-cyclohexanecarbonitrile IUPAC Name: 1-(2-fluoro-4-methoxyphenyl)-4-heptylcyclohexane-1-carbonitrile Traditional Name: 1-(2-fluoro-4-methoxy-phenyl)-4-heptyl-cyclohexanecarbonitrile Formula: C21H30FNO MolecularWeight: 331.467403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)(C#N)C2=C(C=C(C=C2)OC)F

Isomeric SMILES

CCCCCCCC1CCC(CC1)(C#N)C2=C(C=C(C=C2)OC)F

InChI

InChI=1S/C21H30FNO/c1-3-4-5-6-7-8-17-11-13-21(16-23,14-12-17)19-10-9-18(24-2)15-20(19)22/h9-10,15,17H,3-8,11-14H2,1-2H3