O1-docosyl O12-(3-fluoranyldecyl) 2-azanyldodecanedioate

Systemtic Name: O1-docosyl O12-(3-fluoranyldecyl) 2-azanyldodecanedioate Openeye Name: O1-docosyl O12-(3-fluorodecyl) 2-aminododecanedioate CAS Name: 2-aminododecanedioic acid O1-docosyl ester O12-(3-fluorodecyl) ester IUPAC Name: 1-O-docosyl 12-O-(3-fluorodecyl) 2-aminododecanedioate Traditional Name: 2-aminododecanedioic acid O1-behenyl ester O12-(3-fluorodecyl) ester Formula: C44H86FNO4 MolecularWeight: 712.156343

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCOC(=O)C(CCCCCCCCCC(=O)OCCC(CCCCCCC)F)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCOC(=O)C(CCCCCCCCCC(=O)OCCC(CCCCCCC)F)N

InChI

InChI=1S/C44H86FNO4/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26-30-34-39-50-44(48)42(46)36-32-28-24-23-25-29-33-37-43(47)49-40-38-41(45)35-31-27-8-6-4-2/h41-42H,3-40,46H2,1-2H3