2-[2-[(5-chloranyl-2-fluoranyl-phenyl)methyl]-2-oxidanyl-cyclohexyl]ethanenitrile

Systemtic Name: 2-[2-[(5-chloranyl-2-fluoranyl-phenyl)methyl]-2-oxidanyl-cyclohexyl]ethanenitrile Openeye Name: 2-[2-[(5-chloro-2-fluoro-phenyl)methyl]-2-hydroxy-cyclohexyl]acetonitrile CAS Name: 2-[2-[(5-chloro-2-fluorophenyl)methyl]-2-hydroxycyclohexyl]acetonitrile IUPAC Name: 2-[2-[(5-chloro-2-fluorophenyl)methyl]-2-hydroxycyclohexyl]acetonitrile Traditional Name: 2-[2-(5-chloro-2-fluoro-benzyl)-2-hydroxy-cyclohexyl]acetonitrile Formula: C15H17ClFNO MolecularWeight: 281.752983

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)CC#N)(CC2=C(C=CC(=C2)Cl)F)O

Isomeric SMILES

C1CCC(C(C1)CC#N)(CC2=C(C=CC(=C2)Cl)F)O

InChI

InChI=1S/C15H17ClFNO/c16-13-4-5-14(17)11(9-13)10-15(19)7-2-1-3-12(15)6-8-18/h4-5,9,12,19H,1-3,6-7,10H2