ethanoyl fluoride; ethyl 4-[4-(2-azanyl-1-oxidanyl-ethyl)phenoxy]butanoate

Systemtic Name: ethanoyl fluoride; ethyl 4-[4-(2-azanyl-1-oxidanyl-ethyl)phenoxy]butanoate Openeye Name: acetyl fluoride; ethyl 4-[4-(2-amino-1-hydroxy-ethyl)phenoxy]butanoate CAS Name: acetyl fluoride; 4-[4-(2-amino-1-hydroxyethyl)phenoxy]butanoic acid ethyl ester IUPAC Name: acetyl fluoride; ethyl 4-[4-(2-amino-1-hydroxyethyl)phenoxy]butanoate Traditional Name: acetyl fluoride; 4-[4-(2-amino-1-hydroxy-ethyl)phenoxy]butyric acid ethyl ester Formula: C20H30F3NO7 MolecularWeight: 453.44991

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCOC1=CC=C(C=C1)C(CN)O.CC(=O)F.CC(=O)F.CC(=O)F

Isomeric SMILES

CCOC(=O)CCCOC1=CC=C(C=C1)C(CN)O.CC(=O)F.CC(=O)F.CC(=O)F

InChI

InChI=1S/C14H21NO4.3C2H3FO/c1-2-18-14(17)4-3-9-19-12-7-5-11(6-8-12)13(16)10-15;3*1-2(3)4/h5-8,13,16H,2-4,9-10,15H2,1H3;3*1H3