(phenylmethyl) N-[1-cyclohexyl-4,4-bis(fluoranyl)-3-oxidanyl-5-oxidanylidene-octan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-cyclohexyl-4,4-bis(fluoranyl)-3-oxidanyl-5-oxidanylidene-octan-2-yl]carbamate Openeye Name: benzyl N-[1-(cyclohexylmethyl)-3,3-difluoro-2-hydroxy-4-oxo-heptyl]carbamate CAS Name: N-(1-cyclohexyl-4,4-difluoro-3-hydroxy-5-oxooctan-2-yl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(1-cyclohexyl-4,4-difluoro-3-hydroxy-5-oxooctan-2-yl)carbamate Traditional Name: N-[1-(cyclohexylmethyl)-3,3-difluoro-2-hydroxy-4-keto-heptyl]carbamic acid benzyl ester Formula: C22H31F2NO4 MolecularWeight: 411.482646

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(C(C(CC1CCCCC1)NC(=O)OCC2=CC=CC=C2)O)(F)F

Isomeric SMILES

CCCC(=O)C(C(C(CC1CCCCC1)NC(=O)OCC2=CC=CC=C2)O)(F)F

InChI

InChI=1S/C22H31F2NO4/c1-2-9-19(26)22(23,24)20(27)18(14-16-10-5-3-6-11-16)25-21(28)29-15-17-12-7-4-8-13-17/h4,7-8,12-13,16,18,20,27H,2-3,5-6,9-11,14-15H2,1H3,(H,25,28)