(E)-N-[(1S)-1-cyclohexylethyl]-N-methyl-but-2-enamide; cyclopentane; ruthenium(2+); hexafluorophosphate

Systemtic Name: (E)-N-[(1S)-1-cyclohexylethyl]-N-methyl-but-2-enamide; cyclopentane; ruthenium(2+); hexafluorophosphate Openeye Name: (E)-N-[(1S)-1-cyclohexylethyl]-N-methyl-but-2-enamide; cyclopentane; ruthenium(2+); hexafluorophosphate CAS Name: (E)-N-[(1S)-1-cyclohexylethyl]-N-methyl-2-butenamide; cyclopentane; ruthenium(2+); hexafluorophosphate IUPAC Name: (E)-N-[(1S)-1-cyclohexylethyl]-N-methylbut-2-enamide; cyclopentane; ruthenium(2+); hexafluorophosphate Traditional Name: (E)-N-[(1S)-1-cyclohexylethyl]-N-methyl-but-2-enamide; cyclopentane; ruthenium(2+); hexafluorophosphate Formula: C18H22F6NOPRu+ MolecularWeight: 514.40756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N(C)C(C)[C]1[CH][CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Ru+2]

Isomeric SMILES

C/C=C/C(=O)N(C)[C@@H](C)[C]1[CH][CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Ru+2]

InChI

InChI=1S/C13H17NO.C5H5.F6P.Ru/c1-4-8-13(15)14(3)11(2)12-9-6-5-7-10-12;1-2-4-5-3-1;1-7(2,3,4,5)6;/h4-11H,1-3H3;1-5H;;/q;;-1;+2/b8-4+;;;/t11-;;;/m0.../s1