2-[9-(docosoxycarbonylamino)nonyl]-4-fluoranyl-3-methyl-undecanoate

Systemtic Name: 2-[9-(docosoxycarbonylamino)nonyl]-4-fluoranyl-3-methyl-undecanoate Openeye Name: 2-[9-(docosoxycarbonylamino)nonyl]-4-fluoro-3-methyl-undecanoate CAS Name: 2-[9-[[docosoxy(oxo)methyl]amino]nonyl]-4-fluoro-3-methylundecanoate IUPAC Name: 2-[9-(docosoxycarbonylamino)nonyl]-4-fluoro-3-methylundecanoate Traditional Name: 2-[9-(behenyloxycarbonylamino)nonyl]-4-fluoro-3-methyl-undecanoate Formula: C44H85FNO4- MolecularWeight: 711.148403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCOC(=O)NCCCCCCCCCC(C(C)C(CCCCCCC)F)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCOC(=O)NCCCCCCCCCC(C(C)C(CCCCCCC)F)C(=O)[O-]

InChI

InChI=1S/C44H86FNO4/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-31-35-39-50-44(49)46-38-34-30-26-24-25-29-32-36-41(43(47)48)40(3)42(45)37-33-28-9-7-5-2/h40-42H,4-39H2,1-3H3,(H,46,49)(H,47,48)/p-1