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

Systemtic Name: methyl 3-[(4-piperidin-1-ylsulfonylphenyl)carbonyloxymethyl]benzoate Openeye Name: methyl 3-[[4-(1-piperidylsulfonyl)benzoyl]oxymethyl]benzoate CAS Name: 3-[[oxo-[4-(1-piperidinylsulfonyl)phenyl]methoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-piperidin-1-ylsulfonylbenzoyl)oxymethyl]benzoate Traditional Name: 3-[(4-piperidinosulfonylbenzoyl)oxymethyl]benzoic acid methyl ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO6S/c1-27-20(23)18-7-5-6-16(14-18)15-28-21(24)17-8-10-19(11-9-17)29(25,26)22-12-3-2-4-13-22/h5-11,14H,2-4,12-13,15H2,1H3