4-[[4-(1-butoxyethoxy)-4-fluoranyl-1-adamantyl]oxy]-4-chloranyl-2-methyl-hexanenitrile

Systemtic Name: 4-[[4-(1-butoxyethoxy)-4-fluoranyl-1-adamantyl]oxy]-4-chloranyl-2-methyl-hexanenitrile Openeye Name: 4-[[4-(1-butoxyethoxy)-4-fluoro-1-adamantyl]oxy]-4-chloro-2-methyl-hexanenitrile CAS Name: 4-[[4-(1-butoxyethoxy)-4-fluoro-1-adamantyl]oxy]-4-chloro-2-methylhexanenitrile IUPAC Name: 4-[[4-(1-butoxyethoxy)-4-fluoro-1-adamantyl]oxy]-4-chloro-2-methylhexanenitrile Traditional Name: 4-[[4-(1-butoxyethoxy)-4-fluoro-1-adamantyl]oxy]-4-chloro-2-methyl-hexanenitrile Formula: C23H37ClFNO3 MolecularWeight: 429.996183

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C)OC1(C2CC3CC1CC(C3)(C2)OC(CC)(CC(C)C#N)Cl)F

Isomeric SMILES

CCCCOC(C)OC1(C2CC3CC1CC(C3)(C2)OC(CC)(CC(C)C#N)Cl)F

InChI

InChI=1S/C23H37ClFNO3/c1-5-7-8-27-17(4)28-23(25)19-9-18-10-20(23)14-21(12-18,13-19)29-22(24,6-2)11-16(3)15-26/h16-20H,5-14H2,1-4H3