methyl 4-[2-(4-piperidin-1-ylsulfonylphenyl)ethanoyloxymethyl]benzoate

Systemtic Name: methyl 4-[2-(4-piperidin-1-ylsulfonylphenyl)ethanoyloxymethyl]benzoate Openeye Name: methyl 4-[[2-[4-(1-piperidylsulfonyl)phenyl]acetyl]oxymethyl]benzoate CAS Name: 4-[[1-oxo-2-[4-(1-piperidinylsulfonyl)phenyl]ethoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-piperidin-1-ylsulfonylphenyl)acetyl]oxymethyl]benzoate Traditional Name: 4-[[2-(4-piperidinosulfonylphenyl)acetyl]oxymethyl]benzoic acid methyl ester Formula: C22H25NO6S MolecularWeight: 431.502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO6S/c1-28-22(25)19-9-5-18(6-10-19)16-29-21(24)15-17-7-11-20(12-8-17)30(26,27)23-13-3-2-4-14-23/h5-12H,2-4,13-16H2,1H3