2-[4-(4-chloranyl-3-fluoranyl-phenyl)cyclohexyl]-4-methyl-5-octyl-1,3-dioxane

Systemtic Name: 2-[4-(4-chloranyl-3-fluoranyl-phenyl)cyclohexyl]-4-methyl-5-octyl-1,3-dioxane Openeye Name: 2-[4-(4-chloro-3-fluoro-phenyl)cyclohexyl]-4-methyl-5-octyl-1,3-dioxane CAS Name: 2-[4-(4-chloro-3-fluorophenyl)cyclohexyl]-4-methyl-5-octyl-1,3-dioxane IUPAC Name: 2-[4-(4-chloro-3-fluorophenyl)cyclohexyl]-4-methyl-5-octyl-1,3-dioxane Traditional Name: 2-[4-(4-chloro-3-fluoro-phenyl)cyclohexyl]-4-methyl-5-octyl-1,3-dioxane Formula: C25H38ClFO2 MolecularWeight: 425.019423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1COC(OC1C)C2CCC(CC2)C3=CC(=C(C=C3)Cl)F

Isomeric SMILES

CCCCCCCCC1COC(OC1C)C2CCC(CC2)C3=CC(=C(C=C3)Cl)F

InChI

InChI=1S/C25H38ClFO2/c1-3-4-5-6-7-8-9-22-17-28-25(29-18(22)2)20-12-10-19(11-13-20)21-14-15-23(26)24(27)16-21/h14-16,18-20,22,25H,3-13,17H2,1-2H3