3,14-diethyl-3,14-dimethyl-hexadecanedioic acid

Systemtic Name: 3,14-diethyl-3,14-dimethyl-hexadecanedioic acid Openeye Name: 3,14-diethyl-3,14-dimethyl-hexadecanedioic acid CAS Name: 3,14-diethyl-3,14-dimethylhexadecanedioic acid IUPAC Name: 3,14-diethyl-3,14-dimethylhexadecanedioic acid Traditional Name: 3,14-diethyl-3,14-dimethyl-thapsic acid Formula: C22H42O4 MolecularWeight: 370.56648

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CCCCCCCCCCC(C)(CC)CC(=O)O)CC(=O)O

Isomeric SMILES

CCC(C)(CCCCCCCCCCC(C)(CC)CC(=O)O)CC(=O)O

InChI

InChI=1S/C22H42O4/c1-5-21(3,17-19(23)24)15-13-11-9-7-8-10-12-14-16-22(4,6-2)18-20(25)26/h5-18H2,1-4H3,(H,23,24)(H,25,26)