2-(12-methyltridecyl)docosanoic acid

Systemtic Name: 2-(12-methyltridecyl)docosanoic acid Openeye Name: 2-(12-methyltridecyl)docosanoic acid CAS Name: 2-(12-methyltridecyl)docosanoic acid IUPAC Name: 2-(12-methyltridecyl)docosanoic acid Traditional Name: 2-(12-methyltridecyl)behenic acid Formula: C36H72O2 MolecularWeight: 536.95568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCC(C)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCC(C)C)C(=O)O

InChI

InChI=1S/C36H72O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-26-29-32-35(36(37)38)33-30-27-24-21-18-19-22-25-28-31-34(2)3/h34-35H,4-33H2,1-3H3,(H,37,38)