2,3-dimethyldodecanoic acid; 3-methyl-2-propyl-nonanoic acid

Systemtic Name: 2,3-dimethyldodecanoic acid; 3-methyl-2-propyl-nonanoic acid Openeye Name: 2,3-dimethyldodecanoic acid; 3-methyl-2-propyl-nonanoic acid CAS Name: 2,3-dimethyldodecanoic acid; 3-methyl-2-propylnonanoic acid IUPAC Name: 2,3-dimethyldodecanoic acid; 3-methyl-2-propylnonanoic acid Traditional Name: 2,3-dimethyllauric acid; 3-methyl-2-propyl-pelargonic acid Formula: C27H54O4 MolecularWeight: 442.71526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C)C(C)C(=O)O.CCCCCCC(C)C(CCC)C(=O)O

Isomeric SMILES

CCCCCCCCCC(C)C(C)C(=O)O.CCCCCCC(C)C(CCC)C(=O)O

InChI

InChI=1S/C14H28O2.C13H26O2/c1-4-5-6-7-8-9-10-11-12(2)13(3)14(15)16;1-4-6-7-8-10-11(3)12(9-5-2)13(14)15/h12-13H,4-11H2,1-3H3,(H,15,16);11-12H,4-10H2,1-3H3,(H,14,15)