ethyl 9-[[2-fluoranyl-5-(5-pentyl-1,3-dioxan-2-yl)phenyl]methylamino]-9-oxidanylidene-nonanoate

Systemtic Name: ethyl 9-[[2-fluoranyl-5-(5-pentyl-1,3-dioxan-2-yl)phenyl]methylamino]-9-oxidanylidene-nonanoate Openeye Name: ethyl 9-[[2-fluoro-5-(5-pentyl-1,3-dioxan-2-yl)phenyl]methylamino]-9-oxo-nonanoate CAS Name: 9-[[2-fluoro-5-(5-pentyl-1,3-dioxan-2-yl)phenyl]methylamino]-9-oxononanoic acid ethyl ester IUPAC Name: ethyl 9-[[2-fluoro-5-(5-pentyl-1,3-dioxan-2-yl)phenyl]methylamino]-9-oxononanoate Traditional Name: 9-[[5-(5-amyl-1,3-dioxan-2-yl)-2-fluoro-benzyl]amino]-9-keto-pelargonic acid ethyl ester Formula: C27H42FNO5 MolecularWeight: 479.624483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1COC(OC1)C2=CC(=C(C=C2)F)CNC(=O)CCCCCCCC(=O)OCC

Isomeric SMILES

CCCCCC1COC(OC1)C2=CC(=C(C=C2)F)CNC(=O)CCCCCCCC(=O)OCC

InChI

InChI=1S/C27H42FNO5/c1-3-5-9-12-21-19-33-27(34-20-21)22-15-16-24(28)23(17-22)18-29-25(30)13-10-7-6-8-11-14-26(31)32-4-2/h15-17,21,27H,3-14,18-20H2,1-2H3,(H,29,30)