methyl 4-[3-(4-piperidin-1-ylsulfonylphenyl)propanoyloxymethyl]benzoate

Systemtic Name: methyl 4-[3-(4-piperidin-1-ylsulfonylphenyl)propanoyloxymethyl]benzoate Openeye Name: methyl 4-[3-[4-(1-piperidylsulfonyl)phenyl]propanoyloxymethyl]benzoate CAS Name: 4-[[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(4-piperidin-1-ylsulfonylphenyl)propanoyloxymethyl]benzoate Traditional Name: 4-[3-(4-piperidinosulfonylphenyl)propanoyloxymethyl]benzoic acid methyl ester Formula: C23H27NO6S MolecularWeight: 445.52858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H27NO6S/c1-29-23(26)20-10-5-19(6-11-20)17-30-22(25)14-9-18-7-12-21(13-8-18)31(27,28)24-15-3-2-4-16-24/h5-8,10-13H,2-4,9,14-17H2,1H3