O1-tert-butyl O3-methyl 2,4,5-tritert-butylprismane-1,3-dicarboxylate

Systemtic Name: O1-tert-butyl O3-methyl 2,4,5-tritert-butylprismane-1,3-dicarboxylate Openeye Name: O1-tert-butyl O3-methyl 2,4,5-tritert-butylprismane-1,3-dicarboxylate CAS Name: 2,4,5-tritert-butylprismane-1,3-dicarboxylic acid O1-tert-butyl ester O3-methyl ester IUPAC Name: 1-O-tert-butyl 3-O-methyl 2,4,5-tritert-butylprismane-1,3-dicarboxylate Traditional Name: 2,4,5-tritert-butylprismane-1,3-dicarboxylic acid O1-tert-butyl ester O3-methyl ester Formula: C25H40O4 MolecularWeight: 404.5827

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C12C3C1(C4(C3(C24C(=O)OC)C(C)(C)C)C(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C12C3C1(C4(C3(C24C(=O)OC)C(C)(C)C)C(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H40O4/c1-17(2,3)22-14-21(22,15(26)29-20(10,11)12)25(19(7,8)9)23(14,18(4,5)6)24(22,25)16(27)28-13/h14H,1-13H3