4-fluoranyl-2-[9-(hexadecoxycarbonylamino)nonyl]-3-methyl-undecanoic acid

Systemtic Name: 4-fluoranyl-2-[9-(hexadecoxycarbonylamino)nonyl]-3-methyl-undecanoic acid Openeye Name: 4-fluoro-2-[9-(hexadecoxycarbonylamino)nonyl]-3-methyl-undecanoic acid CAS Name: 4-fluoro-2-[9-[[hexadecoxy(oxo)methyl]amino]nonyl]-3-methylundecanoic acid IUPAC Name: 4-fluoro-2-[9-(hexadecoxycarbonylamino)nonyl]-3-methylundecanoic acid Traditional Name: 2-[9-(cetyloxycarbonylamino)nonyl]-4-fluoro-3-methyl-undecanoic acid Formula: C38H74FNO4 MolecularWeight: 627.996863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)NCCCCCCCCCC(C(C)C(CCCCCCC)F)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)NCCCCCCCCCC(C(C)C(CCCCCCC)F)C(=O)O

InChI

InChI=1S/C38H74FNO4/c1-4-6-8-10-11-12-13-14-15-16-17-21-25-29-33-44-38(43)40-32-28-24-20-18-19-23-26-30-35(37(41)42)34(3)36(39)31-27-22-9-7-5-2/h34-36H,4-33H2,1-3H3,(H,40,43)(H,41,42)