1-[2,6,7,7-tetramethyl-6-(3-methylheptan-3-yl)undecyl]cubane

Systemtic Name: 1-[2,6,7,7-tetramethyl-6-(3-methylheptan-3-yl)undecyl]cubane Openeye Name: 1-[6-(1,1-dimethylpentyl)-7-ethyl-2,6,7-trimethyl-undecyl]cubane CAS Name: 1-[2,6,7,7-tetramethyl-6-(3-methylheptan-3-yl)undecyl]cubane IUPAC Name: 1-[2,6,7,7-tetramethyl-6-(3-methylheptan-3-yl)undecyl]cubane Traditional Name: 1-[6-(1,1-dimethylpentyl)-7-ethyl-2,6,7-trimethyl-undecyl]cubane Formula: C31H54 MolecularWeight: 426.76046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(C)(CCCC(C)CC12C3C4C1C5C4C3C25)C(C)(CC)CCCC

Isomeric SMILES

CCCCC(C)(C)C(C)(CCCC(C)CC12C3C4C1C5C4C3C25)C(C)(CC)CCCC

InChI

InChI=1S/C31H54/c1-9-12-16-28(5,6)30(8,29(7,11-3)17-13-10-2)18-14-15-20(4)19-31-25-22-21-23(25)27(31)24(21)26(22)31/h20-27H,9-19H2,1-8H3