[2-[(4-chlorophenyl)sulfanylmethyl]-4-methoxy-5-methyl-oxan-3-yl] 2-azanylethanoate; ethanoyl fluoride

Systemtic Name: [2-[(4-chlorophenyl)sulfanylmethyl]-4-methoxy-5-methyl-oxan-3-yl] 2-azanylethanoate; ethanoyl fluoride Openeye Name: acetyl fluoride; [2-[(4-chlorophenyl)sulfanylmethyl]-4-methoxy-5-methyl-tetrahydropyran-3-yl] 2-aminoacetate CAS Name: acetyl fluoride; 2-aminoacetic acid [2-[[(4-chlorophenyl)thio]methyl]-4-methoxy-5-methyl-3-oxanyl] ester IUPAC Name: acetyl fluoride; [2-[(4-chlorophenyl)sulfanylmethyl]-4-methoxy-5-methyloxan-3-yl] 2-aminoacetate Traditional Name: acetyl fluoride; 2-aminoacetic acid [2-[[(4-chlorophenyl)thio]methyl]-4-methoxy-5-methyl-tetrahydropyran-3-yl] ester Formula: C22H31ClF3NO7S MolecularWeight: 545.99725

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Descriptors Computed from Structure

Canonical SMILES:

CC1COC(C(C1OC)OC(=O)CN)CSC2=CC=C(C=C2)Cl.CC(=O)F.CC(=O)F.CC(=O)F

Isomeric SMILES

CC1COC(C(C1OC)OC(=O)CN)CSC2=CC=C(C=C2)Cl.CC(=O)F.CC(=O)F.CC(=O)F

InChI

InChI=1S/C16H22ClNO4S.3C2H3FO/c1-10-8-21-13(9-23-12-5-3-11(17)4-6-12)16(15(10)20-2)22-14(19)7-18;3*1-2(3)4/h3-6,10,13,15-16H,7-9,18H2,1-2H3;3*1H3