(2-oxidanylidene-2-propan-2-yloxy-ethyl) 4-methyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-oxidanylidene-2-propan-2-yloxy-ethyl) 4-methyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (2-isopropoxy-2-oxo-ethyl) 4-methyl-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-methyl-3-(1-piperidinylsulfonyl)benzoic acid (2-oxo-2-propan-2-yloxyethyl) ester IUPAC Name: (2-oxo-2-propan-2-yloxyethyl) 4-methyl-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-methyl-3-piperidinosulfonyl-benzoic acid (2-isopropoxy-2-keto-ethyl) ester Formula: C18H25NO6S MolecularWeight: 383.4592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)OC(C)C)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)OC(C)C)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C18H25NO6S/c1-13(2)25-17(20)12-24-18(21)15-8-7-14(3)16(11-15)26(22,23)19-9-5-4-6-10-19/h7-8,11,13H,4-6,9-10,12H2,1-3H3