(1S,2S,5R)-5-methyl-2-propan-2-yl-1-pyridin-2-yl-cyclohexan-1-olate; molybdenum; oxygen(2-)

Systemtic Name: (1S,2S,5R)-5-methyl-2-propan-2-yl-1-pyridin-2-yl-cyclohexan-1-olate; molybdenum; oxygen(2-) Openeye Name: (1S,2S,5R)-2-isopropyl-5-methyl-1-(2-pyridyl)cyclohexanolate; molybdenum; oxygen(2-) CAS Name: (1S,2S,5R)-5-methyl-2-propan-2-yl-1-(2-pyridinyl)-1-cyclohexanolate; molybdenum; oxygen(2-) IUPAC Name: (1S,2S,5R)-5-methyl-2-propan-2-yl-1-pyridin-2-ylcyclohexan-1-olate; molybdenum; oxygen(2-) Traditional Name: (1S,2S,5R)-2-isopropyl-5-methyl-1-(2-pyridyl)cyclohexanolate; molybdenum; oxygen(2-) Formula: C30H44MoN2O4-6 MolecularWeight: 592.62136

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)(C2=CC=CC=N2)[O-])C(C)C.CC1CCC(C(C1)(C2=CC=CC=N2)[O-])C(C)C.[O-2].[O-2].[Mo]

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@](C1)(C2=CC=CC=N2)[O-])C(C)C.C[C@@H]1CC[C@H]([C@@](C1)(C2=CC=CC=N2)[O-])C(C)C.[O-2].[O-2].[Mo]

InChI

InChI=1S/2C15H22NO.Mo.2O/c2*1-11(2)13-8-7-12(3)10-15(13,17)14-6-4-5-9-16-14;;;/h2*4-6,9,11-13H,7-8,10H2,1-3H3;;;/q2*-1;;2*-2/t2*12-,13+,15+;;;/m11.../s1