16-methylheptadecyl 3,5,5-trimethylhexanoate

Systemtic Name: 16-methylheptadecyl 3,5,5-trimethylhexanoate Openeye Name: 16-methylheptadecyl 3,5,5-trimethylhexanoate CAS Name: 3,5,5-trimethylhexanoic acid 16-methylheptadecyl ester IUPAC Name: 16-methylheptadecyl 3,5,5-trimethylhexanoate Traditional Name: 3,5,5-trimethylhexanoic acid 16-methylheptadecyl ester Formula: C27H54O2 MolecularWeight: 410.71646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCCOC(=O)CC(C)CC(C)(C)C

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCCOC(=O)CC(C)CC(C)(C)C

InChI

InChI=1S/C27H54O2/c1-24(2)20-18-16-14-12-10-8-7-9-11-13-15-17-19-21-29-26(28)22-25(3)23-27(4,5)6/h24-25H,7-23H2,1-6H3