1,2,3,4,5-pentamethylcyclopentane; (E)-2-phenylethenol; samarium

Systemtic Name: 1,2,3,4,5-pentamethylcyclopentane; (E)-2-phenylethenol; samarium Openeye Name: 1,2,3,4,5-pentamethylcyclopentane; (E)-2-phenylethenol; samarium CAS Name: 1,2,3,4,5-pentamethylcyclopentane; (E)-2-phenylethenol; samarium IUPAC Name: 1,2,3,4,5-pentamethylcyclopentane; (E)-2-phenylethenol; samarium Traditional Name: 1,2,3,4,5-pentamethylcyclopentane; (E)-2-phenylethenol; samarium Formula: C28H38OSm MolecularWeight: 540.96072

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Descriptors Computed from Structure

Canonical SMILES:

C[C]1[C]([C]([C]([C]1C)C)C)C.C[C]1[C]([C]([C]([C]1C)C)C)C.C1=CC=C(C=C1)C=CO.[Sm]

Isomeric SMILES

C[C]1[C]([C]([C]([C]1C)C)C)C.C[C]1[C]([C]([C]([C]1C)C)C)C.C1=CC=C(C=C1)/C=C/O.[Sm]

InChI

InChI=1S/2C10H15.C8H8O.Sm/c2*1-6-7(2)9(4)10(5)8(6)3;9-7-6-8-4-2-1-3-5-8;/h2*1-5H3;1-7,9H;/b;;7-6+;