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: C28H48OSm MolecularWeight: 551.04012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C1C)C)C)C.CC1C(C(C(C1C)C)C)C.C1=CC=C(C=C1)C=CO.[Sm]

Isomeric SMILES

CC1C(C(C(C1C)C)C)C.CC1C(C(C(C1C)C)C)C.C1=CC=C(C=C1)/C=C/O.[Sm]

InChI

InChI=1S/2C10H20.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*6-10H,1-5H3;1-7,9H;/b;;7-6+;