2-(16-methylicosan-5-yl)propanedioic acid

Systemtic Name: 2-(16-methylicosan-5-yl)propanedioic acid Openeye Name: 2-(1-butyl-12-methyl-hexadecyl)propanedioic acid CAS Name: 2-(16-methyleicosan-5-yl)propanedioic acid IUPAC Name: 2-(16-methylicosan-5-yl)propanedioic acid Traditional Name: 2-(1-butyl-12-methyl-hexadecyl)malonic acid Formula: C24H46O4 MolecularWeight: 398.61964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CCCCCCCCCCC(CCCC)C(C(=O)O)C(=O)O

Isomeric SMILES

CCCCC(C)CCCCCCCCCCC(CCCC)C(C(=O)O)C(=O)O

InChI

InChI=1S/C24H46O4/c1-4-6-16-20(3)17-14-12-10-8-9-11-13-15-19-21(18-7-5-2)22(23(25)26)24(27)28/h20-22H,4-19H2,1-3H3,(H,25,26)(H,27,28)