(2-oxidanylidene-2-propan-2-yloxy-ethyl) 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-oxidanylidene-2-propan-2-yloxy-ethyl) 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: (2-isopropoxy-2-oxo-ethyl) 2-chloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)benzoic acid (2-oxo-2-propan-2-yloxyethyl) ester IUPAC Name: (2-oxo-2-propan-2-yloxyethyl) 2-chloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-piperidinosulfonyl-benzoic acid (2-isopropoxy-2-keto-ethyl) ester Formula: C17H22ClNO6S MolecularWeight: 403.87768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)Cl

Isomeric SMILES

CC(C)OC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)Cl

InChI

InChI=1S/C17H22ClNO6S/c1-12(2)25-16(20)11-24-17(21)14-10-13(6-7-15(14)18)26(22,23)19-8-4-3-5-9-19/h6-7,10,12H,3-5,8-9,11H2,1-2H3