methyl 4,4-dimethyldocosanoate

Systemtic Name: methyl 4,4-dimethyldocosanoate Openeye Name: methyl 4,4-dimethyldocosanoate CAS Name: 4,4-dimethyldocosanoic acid methyl ester IUPAC Name: methyl 4,4-dimethyldocosanoate Traditional Name: 4,4-dimethylbehenic acid methyl ester Formula: C25H50O2 MolecularWeight: 382.6633

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(C)(C)CCC(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(C)(C)CCC(=O)OC

InChI

InChI=1S/C25H50O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-25(2,3)23-21-24(26)27-4/h5-23H2,1-4H3