actinium; 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol

Systemtic Name: actinium; 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol Openeye Name: actinium; 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-ol CAS Name: actinium; 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-ol IUPAC Name: actinium; 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol Traditional Name: actinium; 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-ol Formula: C29H50AcO2 MolecularWeight: 657.733847

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)C)O.[Ac]

Isomeric SMILES

CC1=C(C(=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)C)O.[Ac]

InChI

InChI=1S/C29H50O2.Ac/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29;/h20-22,30H,9-19H2,1-8H3;