12-(2-azanylpropan-2-yl)docosanoic acid

Systemtic Name: 12-(2-azanylpropan-2-yl)docosanoic acid Openeye Name: 12-(1-amino-1-methyl-ethyl)docosanoic acid CAS Name: 12-(2-aminopropan-2-yl)docosanoic acid IUPAC Name: 12-(2-aminopropan-2-yl)docosanoic acid Traditional Name: 12-(1-amino-1-methyl-ethyl)behenic acid Formula: C25H51NO2 MolecularWeight: 397.67794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCCCCCCC(=O)O)C(C)(C)N

Isomeric SMILES

CCCCCCCCCCC(CCCCCCCCCCC(=O)O)C(C)(C)N

InChI

InChI=1S/C25H51NO2/c1-4-5-6-7-8-11-14-17-20-23(25(2,3)26)21-18-15-12-9-10-13-16-19-22-24(27)28/h23H,4-22,26H2,1-3H3,(H,27,28)