(3-fluoranyl-4-methoxy-phenyl)methyl 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 2-[4-(1-piperidylsulfonyl)phenyl]acetate CAS Name: 2-[4-(1-piperidinylsulfonyl)phenyl]acetic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 2-(4-piperidin-1-ylsulfonylphenyl)acetate Traditional Name: 2-(4-piperidinosulfonylphenyl)acetic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C21H24FNO5S MolecularWeight: 421.482363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)CC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)CC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)F

InChI

InChI=1S/C21H24FNO5S/c1-27-20-10-7-17(13-19(20)22)15-28-21(24)14-16-5-8-18(9-6-16)29(25,26)23-11-3-2-4-12-23/h5-10,13H,2-4,11-12,14-15H2,1H3